Carbon disulfide (CED0001147)

Record Information
Version1.0
Creation Date2009-03-06 18:58:13 UTC
Update Date2026-04-04 18:05:59 UTC
SynCED IDCED0001147
Secondary Accession Numbers
  • CHEM000159
  • T3D0176
Identification
Common NameCarbon disulfide
ClassSmall Molecule
Description
Carbon disulfide (CS2) is a liquid at room temperature with an average molecular weight of 76.14 g/mol. Carbon disulfide belongs to the other non-metal sulfides, a subclass of other non-metal organides within the inorganic compounds. This exogenous compound is released from 48 recorded sources, including electrical and electronic equipment such as amplifiers, antennas, auxiliary devices, adjustable resistors, and colour television systems. It is also found in household cleaning and consumer products, including bleaching agents, perfumes within detergents and soaps, cigar cigarettes, other smoking requisites, and non electric simulated smoking devices. Additional sources include food, food processing and cookware—specifically food contact materials, food preservation, the preparation of malt, the preparation of wine or sparkling wine, and fermentation processes for beer—as well as building and construction materials such as floors, ceilings, roofs, stairs and ramps, and ladders. It is released in polyethylene terephthalate plastics. Recorded exposure routes include oral, touch, and inhalation (PMC9202949 ). Carbon disulfide inhibits the protein targets cytochrome P450 1A1 (CYP1A1) and cytochrome P450 2E1 (CYP2E1). It also inhibits dopamine beta-hydroxylase (DBH); it is hypothesized that this occurs via the formation of dithiocarbamate metabolites which bind to enzymic copper, as CS2 can react with endogenous amines. Exposure to carbon disulfide is associated with blood pressure (PMC9202949 ).
Contaminant Type
  • Food Toxin
  • Human Neurotoxin
  • Industrial/Workplace Toxin
  • Metabolite
  • Natural Compound
  • Organic Compound
  • Pollutant
  • Solvent
Chemical Structure
Synonyms
ValueSource
Carbon disulphideChEBI
CS2ChEBI
Carbon bisulfideHMDB
Carbon bisulphideHMDB
Carbon disulphide, bsiHMDB
Carbon sulfide (CS2)HMDB
Dithiocarbonic anhydrideHMDB
Disulfide, carbonMeSH, HMDB
Chemical FormulaCS2
Average Molecular Mass76.141 g/mol
Monoisotopic Mass75.944 g/mol
CAS Registry Number75-15-0
IUPAC Namemethanedithione
Traditional Namecarbon disulfide
SMILESS=C=S
InChI IdentifierInChI=1S/CS2/c2-1-3
InChI KeyQGJOPFRUJISHPQ-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of inorganic compounds known as other non-metal sulfides. These are inorganic compounds containing a sulfur atom of an oxidation state of -2, in which the heaviest atom bonded to the oxygen belongs to the class of other non-metals.
KingdomInorganic compounds
Super ClassHomogeneous non-metal compounds
ClassOther non-metal organides
Sub ClassOther non-metal sulfides
Direct ParentOther non-metal sulfides
Alternative Parents
Substituents
  • Other non-metal sulfide
  • Inorganic sulfide
Molecular FrameworkNot Available
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginExogenous
Cellular Locations
  • Cytoplasm
  • Extracellular
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological Roles
  • neurotoxin (PMC9893210 )?A chemical substance that interferes with the normal functioning of the nervous system
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateLiquid
AppearanceNot Available
Experimental Properties
PropertyValue
Melting Point-111.6°C
Boiling Point46.3°C (115.3°F)
Solubility2.16 mg/mL at 20°C
Predicted Properties
PropertyValueSource
Water Solubility1.3 g/LALOGPS
logP2.25ALOGPS
logP1.95ChemAxon
logS-1.8ALOGPS
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity22.37 m³·mol⁻¹ChemAxon
Polarizability6.79 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyDeposition DateView
Predicted GC-MSPredicted GC-MS Spectrumsplash10-004i-9000000000-1be1dd1539f07de91257Not AvailableView Spectrum
Predicted GC-MSPredicted GC-MS SpectrumNot AvailableNot AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-004i-9000000000-c32b774f5ef5f9e3b3b5Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-004i-9000000000-c32b774f5ef5f9e3b3b5Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-004i-9000000000-c32b774f5ef5f9e3b3b5Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-00di-9000000000-f8b0b78f7785ba1a8d02Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-00di-9000000000-f8b0b78f7785ba1a8d02Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-00di-9000000000-f8b0b78f7785ba1a8d02Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-004i-9000000000-05fa4e3edea82fd450a4Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-004i-9000000000-05fa4e3edea82fd450a4Not AvailableView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrumsplash10-004i-9000000000-05fa4e3edea82fd450a4Not AvailableView Spectrum
MSMS Spectrumsplash10-004i-9000000000-4fd31585d55b0b9843c4Not AvailableView Spectrum
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
3020.0 mg/kg/day MouseLD50OralexperimentalNot Available8
0.08 ml/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
10.0 ppm House MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.42 mL/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/m3 RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/m3 RatLOELdermalexperimentalNot AvailableECOTOX - EPA ORD
10.0 ppm RatNOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
172.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
3.32 mmol/kg RatLOELdermalexperimentalNot AvailableECOTOX - EPA ORD
1.66 mmol/kg RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
50.0 mg/m3 RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
6.64 mmol/kg RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
3.32 mmol/kg RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
1000.0 mg/m3 RatLOELdermalexperimentalNot AvailableECOTOX - EPA ORD
3.32 mmol/kg RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1.66 mmol/kg RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 mmol/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.08 ml/kg RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
286.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
172.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
10.0 ppm RatNOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
0.08 ml/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
10.0 ppm RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
375.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
375.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
50.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
300.0 mg/kg-day RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
20.0 ul/org RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/m3 RatLOELdermalexperimentalNot AvailableECOTOX - EPA ORD
375.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
8.3 mmol/kg RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
1.0 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
3.32 mmol/kg RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
100.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
30.0 uL RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
30.0 mg/kg-day MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
5.0 mmol/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
0.1 mmol/kg RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
750.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
400.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
30.0 uL RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
20.0 ul/org RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
3.4 mmol/kg RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
0.33 mmol/100 g bdwt RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
625.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/m3 RatNOELdermalexperimentalNot AvailableECOTOX - EPA ORD
5.0 ul/org RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
20.0 ul/org RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
80.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
200.0 mg/kg-day RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
20.0 ppm RatNOELenvironmentalexperimentalNot AvailableECOTOX - EPA ORD
3.3 mmol/kg RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
4.9 mmol/kg RatLOELoralexperimentalNot AvailableECOTOX - EPA ORD
3.0 mg/kg-day MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
500.0 mg/kg-day RatLOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
1.0 mg/kg-day MouseLOELoralexperimentalNot AvailableECOTOX - EPA ORD
10.0 mmol/kg RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
20.0 ul/org RatNOELinjectionexperimentalNot AvailableECOTOX - EPA ORD
600.0 mg/kg-day RatNOELoralexperimentalNot AvailableECOTOX - EPA ORD
30.0 mg/kg-day MouseNOELoralexperimentalNot AvailableECOTOX - EPA ORD
25.0 mg/kg-day European RabbitLOELoralexperimentalNot AvailableECOTOX - EPA ORD
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityCarbon disulfide is a potent nerve toxin and also affect liver enzymes, particularly those related to lipid metabolism. The increases in serum cholesterol that are sometimes seen following carbon disulfide exposure may be a result of increased hepatic cholesterol synthesis. The primary target of carbon disulfide appears to be the nervous system. Neurophysiological and behavioral effects as well as pathomorphology of peripheral nervous system structures have been reported in humans. Moreover, carbon disulfide metabolites of the thiocarbamate type inhibit aldehyde anhydrase. (8, 7)
Carcinogenicity (IARC Classification)No indication of carcinogenicity to humans (not listed by IARC).
Minimum Risk LevelChronic Inhalation: 0.3 ppm (8) Acute Oral: 0.01 mg/kg/day (8)
SymptomsDizziness, headache, nausea, shortness of breath, vomiting, weakness, irritability and hallucination can result from inhalation, ingestion or skin exposure to carbon disultfide. Skin and eye exposure can lead to pain, redness. Moreover, dermal exposure can lead to dryness of the skin; the carbon disulfide may be absorbed. Weak pulse, palpitations, fatigue, weakness in the legs, unsteady gait, vertigo, hyperesthesia, agitation, mania, hallucinations of sight, hearing, taste, and smell in acute are other symtoms of carbon disulfide poisoning. (9, 10)
TreatmentFollowing oral exposure, administer charcoal as a slurry (240 mL water/30 g charcoal). Consider gastric lavage after ingestion of a potentially life-threatening amount of poison if it can be performed soon after ingestion (generally within 1 hour). Intravenous urea (0.5 to 1.5 g/kg) has been recommended to inactivate free carbon disulfide in the blood. The efficacy of this treatment is unknown. Following inhalation exposure, move patient to fresh air. Monitor for respiratory distress. If cough or difficulty breathing develops, evaluate for respiratory tract irritation, bronchitis, or pneumonitis. Administer oxygen and assist ventilation as required. Treat bronchospasm with inhaled beta2 agonist and oral or parenteral corticosteroids. If the exposure occurred through eye exposure, irrigate exposed eyes with copious amounts of room temperature water for at least 15 minutes. If the exposure occurred through dermal contact, remove contaminated clothing and wash exposed area thoroughly with soap and water. (11)
Health Effects
Health EffectRelationshipDirectionDescriptionReference
blood pressureAssociated With?Not AvailableNot AvailablePMC9202949
cancerHas Therapeutic Effect OnNot AvailableCancer is a group of diseases involving abnormal cell growth with the potential to invade or spread to other parts of the body. Possible signs and symptoms include a lump, abnormal bleeding, prolonged cough, unexplained weight loss, and a change in bowel movements. There are over 100 types of cancers affect humans. The risk of developing certain cancers can be reduced by not smoking, maintaining a healthy weight, not drinking too much alcohol, eating plenty of vegetables, fruits and whole grains, vaccination against certain infectious diseases, not eating too much processed and red meat and avoiding too much sunlight exposure. Cancer is often treated with some combination of radiation therapy, surgery, chemotherapy and targeted therapy. The majority of cancers, some 90–95% of cases, are due to genetic mutations from environmental and lifestyle factors. The remaining 5–10% are due to inherited genetics.PMC12234022
asthmaAssociated With?Not AvailableA bronchial disease that is characterized by chronic inflammation and narrowing of the airways, which is caused by a combination of environmental and genetic factors. The disease has symptom recurring periods of wheezing (a whistling sound while breathing), has symptom chest tightness, has symptom shortness of breath, has symptom mucus production and has symptom coughing. The symptoms appear due to a variety of triggers such as allergens, irritants, respiratory infections, weather changes, exercise, stress, reflux disease, medications, foods and emotional anxiety. (DO)PMC11316258
schizophreniaAssociated With?decreaseA psychotic disorder that is characterized by a disintegration of thought processes and of emotional responsiveness. (DO)PMC4085177
schizophreniaAssociated With?Not AvailableA psychotic disorder that is characterized by a disintegration of thought processes and of emotional responsiveness. (DO)PMC9893210
deliriumAssociated With?decreaseA disorder characterized by the acute and sudden development of confusion, illusions, movement changes, inattentiveness, agitation, and hallucinations. Usually, it is a reversible condition. (NCI CTCAE)PMC4085177
neuropathyAssociated With?Not AvailableA nervous system disease that is located in nerves or nerve cells. (do).PMC9202949 , PMC4085177
coronary artery diseaseAssociated With?Not AvailableAn artery disease that is characterized by plaque building up along the inner walls of the arteries of the heart resulting in a narrowing of the arteries and a reduced blood supply to the cardiac muscles. (DO)PMC4085177
miscarriageAssociated With?Not AvailableA natural death of an embryo or fetus before it is able to survive independently.PMC7038808
pancreatic cancerHas Therapeutic Effect OnNot AvailableAn endocrine gland cancer located in the pancreas. (DO)PMC12234022
cerebral infarctionAssociated With?Not AvailableAn ischemic condition of the brain, producing a persistent focal neurological deficit in the area of distribution of the cerebral arteries.PMC4085177
Toxic encephalopathyAssociated With?Not AvailableNot AvailablePMC9281386
bipolar disorderAssociated With?decreaseA mood disorder that involves alternating periods of mania and depression. (DO)PMC4085177
glomerulosclerosisAssociated With?Not AvailableA glomerulonephritis that is characterized by hardening of the glomerulus in the kidney. (DO)PMC4085177
cardiovascular disorderAssociated With?Not AvailableNot AvailablePMC4712444
CognitionAssociated With?Not AvailableNot AvailablePMC9202949
central nervous system disorderAssociated With?Not AvailableNot AvailablePMC4085177
Abdominal distentionAssociated With?increaseNot AvailablePMC12565842
Progressive hearing impairmentAssociated With?Not AvailableNot AvailablePMC3023345
ErythemaAssociated With?Not AvailableNot AvailablePMC10303832
retinal disorderAssociated With?Not AvailableNot AvailablePMC4085177
mental disorderAssociated With?Not AvailableNot AvailablePMC4085177
MemoryAssociated With?Not AvailableNot AvailablePMC9202949
LearningAssociated With?Not AvailableNot AvailablePMC9202949
menstrual disorderAssociated With?Not AvailableNot AvailablePMC7038808
Brain Damage, ChronicAssociated With?Not AvailableNot AvailablePMC4085177
optic neuritisAssociated With?Not AvailableNot AvailablePMC4085177
BlisterAssociated With?Not AvailableNot AvailablePMC10303832
Skin AbnormalitiesAssociated With?Not AvailableNot AvailablePMC4270264
Exposure Sources
Source IDSourceSectorReference
CEDs000010Insecticides?Insecticides are synthetic chemicals designed to control or eliminate insect pests that threaten crops and other agricultural products.Agriculture & land managementPubChem
CEDs000070Stormwater runoff?Stormwater runoff refers to the flow of rainwater or melted snow that does not soak into the ground and instead collects pollutants as it travels over impervious surfaces such as roads and parking lots.Automotive & urban infrastructurePubChem
CEDs000181Ballast water?Ballast water, taken on by ships to maintain stability and balance, often contains a diverse array of microorganisms, including bacteria, viruses, and plankton.Marine, shipping & aquaculturePubChem
CEDs000182Bilge water?Bilge water is a byproduct generated from the accumulation of water in the lowest part of a ship's hull, which may include a mixture of seawater, oil, fuel residues, and various contaminants.Marine, shipping & aquaculturePubChem
CEDs000233Brushes?Brushes used in personal care and cosmetics can be a source of synthetic chemical contamination due to the materials and coatings used in their manufacturing.Personal care & cosmeticsPubChem
CEDs000494Food contact materials?Food contact materials refer to substances and products that are intended to come into contact with food during processing, packaging, or preparation.Food, food processing & cookwareNot Available
CEDs000495Ceilings?Ceilings in built environments can be a source of synthetic chemical contamination due to the materials used in their construction and finishes.Building & ConstructionPubChem
CEDs000497Floors?Floors in built environments can be a significant source of synthetic chemical contamination due to the materials and finishes used in their construction.Building & ConstructionPubChem
CEDs000498Ladders?Ladders, commonly used in various construction and maintenance activities, can become a source of synthetic chemical contamination due to the materials and coatings applied during their manufacture and use.Building & ConstructionPubChem
CEDs000499Roofs?Roofs can be a significant source of synthetic chemical contamination due to the materials used in their construction and maintenance.Building & ConstructionPubChem
CEDs000500Stairs And Ramps?Stairs and ramps in construction are often treated with various synthetic chemicals to enhance durability, slip resistance, and weather resistance.Building & ConstructionPubChem
CEDs000503Tents Or Canopies?Tents and canopies used in various applications can be a source of synthetic chemical contamination primarily due to the materials from which they are made.Building & ConstructionPubChem
CEDs000504Adjustable Resistors?Adjustable resistors, commonly used in various electronic devices, can contribute to synthetic chemical contamination through the materials and substances used in their manufacturing and disposal.Electrical & Electronic EquipmentPubChem
CEDs000505Amplifiers?Amplifiers, commonly used in various electronic devices to enhance signal strength, can be a source of synthetic chemical contamination due to the materials and processes involved in their production and disposal.Electrical & Electronic EquipmentPubChem
CEDs000506Antennas?Antennas, commonly used in communication technologies, can be a source of synthetic chemical contamination through the materials and coatings used in their construction.Electrical & Electronic EquipmentPubChem
CEDs000507Auxiliary Devices?Auxiliary devices, such as capacitors, transformers, and circuit breakers, are integral components in various electronic systems.Electrical & Electronic EquipmentPubChem
CEDs000509Colour Television Systems?Colour television systems contain various synthetic chemicals that can lead to environmental contamination.Electrical & Electronic EquipmentPubChem
CEDs000511Conductors Or Conductive Bodies Characterised By The Conductive Materials?Conductors, or conductive bodies, are materials that allow the flow of electrical current, typically made from metals such as copper, aluminum, or silver.Electrical & Electronic EquipmentPubChem
CEDs000514Discharge Lamps?Discharge lamps, including fluorescent and high-intensity discharge (HID) lamps, are commonly used for lighting applications due to their energy efficiency and brightness.Electrical & Electronic EquipmentPubChem
CEDs000517Electric Switches?Electric switches, integral components in numerous devices, can be a source of synthetic chemical contamination due to the materials and manufacturing processes involved in their production.Electrical & Electronic EquipmentPubChem
CEDs000518Electrically Stimulated Smoking Devices?Electrically stimulated smoking devices, commonly known as e-cigarettes or vape pens, utilize electrical components to heat a liquid solution, often containing nicotine, flavorings, and other additives, to produce an aerosol for inhalation.Electrical & Electronic EquipmentPubChem
CEDs000519Electrodes?Electrodes, used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials from which they are constructed and the processes involved in their manufacturing.Electrical & Electronic EquipmentPubChem
CEDs000521Fixed Capacitors And Their Manufacture?Fixed capacitors are passive electronic components used to store and release electrical energy, playing a critical role in various circuits.Electrical & Electronic EquipmentPubChem
CEDs000523Gas Filled Discharge Tubes With Solid Cathode?Gas Filled Discharge Tubes with Solid Cathodes are electrical components that facilitate the flow of current by ionizing gas within a sealed tube.Electrical & Electronic EquipmentPubChem
CEDs000524Hybrid Capacitors?Hybrid capacitors are energy storage devices that combine the properties of electrolytic and supercapacitors, utilizing a combination of electrochemical principles to achieve higher energy density and power density.Electrical & Electronic EquipmentPubChem
CEDs000525Line Transmission Systems?Line Transmission Systems, commonly used for the distribution of electrical energy, can be a source of synthetic chemical contamination through the insulation materials and coatings utilized in their construction.Electrical & Electronic EquipmentPubChem
CEDs000527Magnets?Magnets, commonly used in various electrical and electronic applications, can be a source of synthetic chemical contamination due to the materials used in their production.Electrical & Electronic EquipmentPubChem
CEDs000529Power Cables?Power cables are used to transmit electrical energy and are typically composed of conductive materials, insulation, and protective coatings.Electrical & Electronic EquipmentPubChem
CEDs000530Radio Transmission Systems?Radio transmission systems utilize a variety of synthetic chemicals in their manufacturing and maintenance processes.Electrical & Electronic EquipmentPubChem
CEDs000532Selectors?Selectors are components used in various electronic devices to control the flow of electrical signals.Electrical & Electronic EquipmentPubChem
CEDs000535Superconducting Magnets And Superconducting Coils?Superconducting magnets and coils are utilized in various applications that require strong magnetic fields, such as magnetic resonance imaging (MRI) and particle accelerators.Electrical & Electronic EquipmentPubChem
CEDs000536Superconductive Or Hyperconductive Conductors Cables Or Transmission Lines?Superconductive or hyperconductive conductors, including cables and transmission lines, are materials that exhibit zero electrical resistance under specific conditions, typically at low temperatures.Electrical & Electronic EquipmentPubChem
CEDs000537Television Systems?Television systems can be a source of synthetic chemical contamination due to the various materials and components used in their manufacture and operation.Electrical & Electronic EquipmentPubChem
CEDs000538Thin Magnetic Films?Thin magnetic films are layers of magnetic material ranging from a few nanometers to several micrometers in thickness, commonly used in applications such as magnetic sensors, data storage devices, and electronic components.Electrical & Electronic EquipmentPubChem
CEDs000540X Ray Tubes?X-ray tubes are devices used to produce X-rays for various applications, including medical imaging and industrial inspections.Electrical & Electronic EquipmentPubChem
CEDs000544Fermentation Processes For Beer?Fermentation processes for beer involve the conversion of sugars into alcohol and carbon dioxide by yeast.Food, food processing & cookwarePubChem
CEDs000545Food Preservation?Food preservation often involves the use of synthetic chemicals, such as preservatives, flavor enhancers, and color additives, to extend shelf life and enhance the sensory qualities of food products.Food, food processing & cookwarePubChem
CEDs000547Preparation Of Malt?Malt preparation involves the germination and drying of cereal grains, primarily barley, to produce malt for brewing and food products.Food, food processing & cookwarePubChem
CEDs000549Preparation Of Wine Or Sparkling Wine?The preparation of wine or sparkling wine involves various stages, including fermentation, aging, and bottling, which can introduce potential sources of synthetic chemical contamination.Food, food processing & cookwarePubChem
CEDs000550Preparation Of Wort?The preparation of wort involves the extraction of sugars from malted grains, a crucial step in the brewing process.Food, food processing & cookwarePubChem
CEDs000552Processing Meats?Processing meats can lead to synthetic chemical contamination primarily through the use of additives and preservatives.Food, food processing & cookwarePubChem
CEDs000553Treatment Of Hops?Hops, a key ingredient in brewing and food flavoring, can be a source of synthetic chemical contamination due to various agricultural practices.Food, food processing & cookwarePubChem
CEDs000555Bleaching Agents?Bleaching agents are chemical substances used to whiten or lighten materials, often employed in various cleaning products for their stain removal and disinfecting properties.Household cleaning & consumer productsPubChem
CEDs000556Cigar Cigarettes?Cigar cigarettes are a source of synthetic chemical contamination due to the combustion of various tobacco blends and additives.Household cleaning & consumer productsPubChem
CEDs000559Non Electric Simulated Smoking Devices?Non-electric simulated smoking devices, often designed to mimic the experience of smoking without combustion, can be sources of synthetic chemical contamination due to the materials and chemicals used in their construction and operation.Household cleaning & consumer productsPubChem
CEDs000560Other Smoking Requisites?Other smoking requisites, including items such as lighters, matches, and rolling papers, can introduce synthetic chemical contamination through various components and additives.Household cleaning & consumer productsPubChem
CEDs000561Perfumes Within Detergents And Soaps?Perfumes within detergents and soaps are synthetic fragrance compounds added to enhance the sensory experience of cleaning products.Household cleaning & consumer productsPubChem
CEDs000562Pipe Accessories?Pipe accessories, such as fittings, connectors, and seals, are components used in plumbing systems to facilitate the flow of liquids and gases.Household cleaning & consumer productsPubChem
CEDs000563Soap Detergents?Soap detergents are synthetic surfactants designed to enhance the cleaning efficacy of water by reducing surface tension, allowing for better interaction with dirt and grease.Household cleaning & consumer productsPubChem
CEDs000564Soap Dispensers?Soap dispensers, commonly used for dispensing liquid soaps and sanitizers, can become a source of synthetic chemical contamination due to the materials used in their construction and the products they dispense.Household cleaning & consumer productsPubChem
CEDs000566Tobacco Pipes?Tobacco pipes, often made from materials such as plastic, wood, or metal, can serve as sources of synthetic chemical contamination due to the residues left by tobacco products.Household cleaning & consumer productsPubChem
CEDs000567Tobacco Product Cases?Tobacco product cases can serve as a source of synthetic chemical contamination due to the presence of various additives and chemicals used in tobacco processing and product manufacturing.Household cleaning & consumer productsPubChem
CEDs000569Tobacco Smoke Filters?Tobacco smoke filters are designed to reduce the inhalation of harmful substances in cigarette smoke, including tar and other particulate matter.Household cleaning & consumer productsPubChem
CEDs000578Making Cigars?The process of making cigars involves several steps, including the cultivation of tobacco, fermentation, and the application of various additives to enhance flavor and preservation.Industrial manufacturing & chemical processingPubChem
CEDs000579Manufacture Of Iron Or Steel?The manufacture of iron or steel involves various processes, including smelting, refining, and alloying, which can result in the release of synthetic chemicals and contaminants.Industrial manufacturing & chemical processingPubChem
CEDs000580Manufacture Preparation Of Tobacco Products?The manufacture and preparation of tobacco products involve various processes that can result in the introduction of synthetic chemicals into the environment.Industrial manufacturing & chemical processingPubChem
CEDs000581Paper Making Machines?Paper making machines utilize various synthetic chemicals throughout the production process, including additives, coatings, and bleaching agents.Industrial manufacturing & chemical processingPubChem
CEDs000583Anchoring Equipment?Anchoring equipment, commonly used in marine applications, can be a source of synthetic chemical contamination due to the materials and coatings utilized in their manufacturing.Marine, shipping & aquaculturePubChem
CEDs000589Life Buoys?Life buoys, commonly used in marine environments for safety and rescue operations, can be a source of synthetic chemical contamination due to the materials used in their production.Marine, shipping & aquaculturePubChem
CEDs000592Marine Propulsion Or Steering?Marine propulsion and steering systems often rely on various synthetic chemicals, including lubricants, fuels, and hydraulic fluids.Marine, shipping & aquaculturePubChem
CEDs000596Acaricides?Acaricides are synthetic chemicals specifically designed to target and control mite populations that can damage crops and plants.Agriculture & land managementPubChem
CEDs000597Chemosterilants?Chemosterilants are synthetic chemicals designed to induce sterility in target pest populations, thereby controlling their reproduction and mitigating damage to crops.Agriculture & land managementPubChem
CEDs000598Fertiliser Distributors?Fertiliser distributors play a critical role in the supply of synthetic fertilizers, which are widely used to enhance soil fertility and crop yield.Agriculture & land managementPubChem
CEDs000600Herbicides And Algicides?Herbicides and algicides are synthetic chemicals primarily used to control unwanted plants and algae in various environments.Agriculture & land managementPubChem
CEDs000602Molluscicides?Molluscicides are synthetic chemicals specifically designed to control and eliminate mollusks, such as snails and slugs, which can be detrimental to crops and agricultural productivity.Agriculture & land managementPubChem
CEDs000603Nematocides?Nematocides are synthetic chemicals specifically designed to control nematodes, which are microscopic roundworms that can cause significant damage to crops and plants.Agriculture & land managementPubChem
CEDs000604Pest Attractants?Pest attractants are synthetic chemicals designed to lure specific pests for monitoring or control purposes.Agriculture & land managementPubChem
CEDs000605Pest Repellants?Pest repellents, often formulated from synthetic chemicals, are widely used to protect crops from insect infestations and other pests.Agriculture & land managementPubChem
CEDs000606Plant Growth Regulators?Plant Growth Regulators (PGRs) are synthetic chemicals designed to influence the growth and development of plants.Agriculture & land managementPubChem
CEDs000607Rodenticides(1)?Rodenticides are synthetic chemicals specifically formulated to control rodent populations, serving as a crucial tool in managing pests that can damage crops and spread diseases.Agriculture & land managementPubChem
CEDs000608Rodenticides?Rodenticides are chemical substances specifically designed to control rodent populations by causing death through various mechanisms, including anticoagulation or neurotoxicity.Agriculture & land managementPubChem
CEDs000611Anti Perspirants Or Body Deoderants?Antiperspirants and body deodorants commonly contain synthetic chemicals such as aluminum compounds, parabens, and synthetic fragrances.Personal care & cosmeticsPubChem
CEDs000612Body Washing Or Cleaning Implements?Body washing or cleaning implements, such as synthetic sponges, loofahs, and washcloths, can be sources of synthetic chemical contamination due to the materials used in their production.Personal care & cosmeticsPubChem
CEDs000613Depilatories?Depilatories are products designed to remove unwanted hair through the application of synthetic chemicals that break down the protein structure of hair, facilitating its removal.Personal care & cosmeticsPubChem
CEDs000614Essential Oils Or Perfumes?Essential oils and perfumes are complex mixtures of volatile compounds derived from natural or synthetic sources, commonly used for their aromatic properties.Personal care & cosmeticsPubChem
CEDs000615Eye Makeup Products?Eye makeup products, including mascaras, eyeliners, and eyeshadows, often contain a variety of synthetic chemicals such as pigments, preservatives, and film-forming agents.Personal care & cosmeticsPubChem
CEDs000616Face Mask Cosmetics?Face mask cosmetics often contain a variety of synthetic chemicals, including preservatives, emulsifiers, and fragrances, which can contribute to chemical contamination.Personal care & cosmeticsPubChem
CEDs000617Lip Care Products?Lip care products, including lipsticks, balms, and glosses, often contain a variety of synthetic chemicals such as parabens, phthalates, and synthetic fragrances.Personal care & cosmeticsPubChem
CEDs000618Lip Makeup Products?Lip makeup products, such as lipsticks, lip glosses, and lip liners, often contain a variety of synthetic chemicals, including pigments, preservatives, and emollients.Personal care & cosmeticsPubChem
CEDs000619Manicure Pedicure?Manicure and pedicure procedures often involve the use of various synthetic chemicals, including solvents, nail polishes, and nail adhesives.Personal care & cosmeticsPubChem
CEDs000630Toys?Toys, particularly those made from synthetic materials such as plastics, can be a source of chemical contamination due to the presence of various additives and compounds used in their production.Recreation & sports surfacesPubChem
CEDs000632Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.Textiles, leather & furnishingsPubChem
CEDs000635Buttons?Buttons, often made from synthetic materials such as polyester, nylon, or polycarbonate, can be a source of synthetic chemical contamination during their production, use, and disposal.Textiles, leather & furnishingsPubChem
CEDs000638Decorating Textiles?Decorating textiles often involves the use of synthetic chemicals such as dyes, finishes, and coatings.Textiles, leather & furnishingsPubChem
CEDs000640Embroidering And Tufting?Embroidering and tufting processes often involve the use of synthetic chemicals such as dyes, adhesives, and finishing agents.Textiles, leather & furnishingsPubChem
CEDs000641Foam Dyeing?Foam dyeing is a textile dyeing technique that utilizes a foaming agent to create a dye solution in a gaseous form, allowing for the application of dyes onto fabrics.Textiles, leather & furnishingsPubChem
CEDs000642Footwear?Footwear production often involves the use of various synthetic chemicals, such as adhesives, dyes, and treatments, which can contribute to environmental contamination.Textiles, leather & furnishingsPubChem
CEDs000643Headwear?Headwear made from synthetic materials often incorporates chemicals used in the manufacturing and finishing processes, such as dyes, flame retardants, and water repellents.Textiles, leather & furnishingsPubChem
CEDs000644Hook Or Eye Fasteners?Hook or eye fasteners are commonly used in various applications, including clothing and upholstery, to secure fabric and enhance functionality.Textiles, leather & furnishingsPubChem
CEDs000647Multicolour Dyeing?Multicolour dyeing involves the application of multiple synthetic dyes to textiles and other materials to achieve vibrant, diverse color patterns.Textiles, leather & furnishingsPubChem
CEDs000650Purses Luggage Hand Bags?Purses, luggage, and handbags are often manufactured using synthetic materials such as polyvinyl chloride (PVC), polyurethane, and various types of nylon.Textiles, leather & furnishingsPubChem
CEDs000652Ropes?Ropes manufactured from synthetic fibers, such as polypropylene, nylon, and polyester, are widely used in various applications, including marine, construction, and outdoor activities.Textiles, leather & furnishingsPubChem
CEDs000653Sewing?Sewing processes often involve the use of various synthetic chemicals, which can become sources of contamination in the environment.Textiles, leather & furnishingsPubChem
CEDs000655Slide Fasteners?Slide fasteners, commonly known as zippers, are mechanical devices used to join two edges of fabric or other materials.Textiles, leather & furnishingsPubChem
CEDs000656Snap Fasteners?Snap fasteners, commonly used in clothing and upholstery, can be made from various synthetic materials, including plastics and metal alloys.Textiles, leather & furnishingsPubChem
CEDs000657Surface Finishing Of Leather?Surface finishing of leather often involves the use of various synthetic chemicals, including dyes, resins, and finishing agents.Textiles, leather & furnishingsPubChem
CEDs000658Touch Fasteners?Touch fasteners, commonly known as hook-and-loop fasteners, are composed of synthetic materials such as nylon or polyester.Textiles, leather & furnishingsPubChem
CEDs000661Umbrellas?Umbrellas are commonly manufactured using synthetic materials such as polyester, nylon, and polyvinyl chloride (PVC), which can contribute to synthetic chemical contamination.Textiles, leather & furnishingsPubChem
CEDs000662Yarns Or Threads?Yarns or threads used in textiles can be a source of synthetic chemical contamination due to the production processes and treatments they undergo.Textiles, leather & furnishingsPubChem
CEDs000663Sanitary Equipment?Sanitary equipment, including toilets, sinks, and drainage systems, can serve as conduits for synthetic chemical contamination.Wastewater, sanitation & biosolidsPubChem
CEDs000664Fire Fighting Gels?Fire fighting gels are synthetic chemical formulations designed to enhance fire suppression effectiveness by creating a protective barrier against heat and flames.Fire suppression systems & agentsPubChem
CEDs000665Fire Extinguishers?Fire extinguishers contain various synthetic chemicals designed to suppress flames and prevent the spread of fire.Fire suppression systems & agentsPubChem
CEDs000666Flame Traps?Flame traps are devices designed to prevent the propagation of flames and explosions by allowing gases to escape while blocking flames.Fire suppression systems & agentsPubChem
CEDs000669PFAS Fire Fighting Foam?PFAS fire fighting foam refers to a class of synthetic foams containing per- and polyfluoroalkyl substances (PFAS), which are designed to suppress flammable liquid fires.Fire suppression systems & agentsPubChem
CEDs000671Airplanes And Helicopters?Airplanes and helicopters are significant sources of synthetic chemical contamination primarily through the use of aviation fuels, lubricants, and de-icing agents.Aviation & AerospacePubChem
CEDs000672Light Than Air Aircraft?Light than air aircraft, such as dirigibles and airships, utilize lifting gases like helium or hydrogen for buoyancy.Aviation & AerospacePubChem
CEDs000673Unmanned Aerial Vehicles?Unmanned Aerial Vehicles (UAVs), commonly known as drones, utilize various synthetic chemicals in their manufacturing, operation, and maintenance processes.Aviation & AerospacePubChem
CEDs000678Nitrogenous Fertilisers?Nitrogenous fertilizers are synthetic chemical compounds primarily used to enhance plant growth by supplying essential nitrogen, a crucial nutrient for photosynthesis and protein synthesis.Agriculture & land managementPubChem
CEDs000679Phosphatic Fertilisers?Phosphatic fertilizers are synthetic chemical products primarily composed of phosphorus, which is essential for plant growth.Agriculture & land managementPubChem
CEDs000684Cements?Cements are a composite material primarily used as a binding agent in construction applications, formed by the calcination of limestone and clay minerals at high temperatures.Building & ConstructionPubChem
CEDs000685Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.Building & ConstructionPubChem
CEDs000686Clay Wares?Clay wares are ceramic products made from natural clay, often utilized in various construction applications such as tiles, bricks, and sanitary ware.Building & ConstructionPubChem
CEDs000687Crystal Glass?Crystal glass, known for its clarity and brilliance, is often produced using lead oxide, which enhances its refractive quality.Building & ConstructionPubChem
CEDs000688Glass Coatings?Glass coatings are synthetic chemical formulations applied to glass surfaces to enhance properties such as durability, UV resistance, and aesthetic appeal.Building & ConstructionPubChem
CEDs000691Non Oxide Glass?Non-oxide glass refers to a category of glasses primarily composed of materials other than silicon dioxide, such as boron oxide or phosphorous oxide.Building & ConstructionPubChem
CEDs000692Silica Free Oxide Glass?Silica Free Oxide Glass is a type of glass that is produced using alternative materials to traditional silica-based formulations.Building & ConstructionPubChem
CEDs000693Silica Glass?Silica glass, primarily composed of silicon dioxide (SiO2), is widely used in various applications, including windows, glass facades, and insulation materials.Building & ConstructionPubChem
CEDs000696Nanotechnology?Nanotechnology involves the manipulation of materials at the molecular or atomic level, typically within the range of 1 to 100 nanometers.Industrial manufacturing & chemical processingPubChem
CEDs000698Jewellery?Jewellery production often involves the use of various synthetic chemicals during the extraction and processing of metals.Mining & metal processingPubChem
CEDs000699Mining Or Quarrying?Mining and quarrying operations can lead to synthetic chemical contamination through the release of various pollutants associated with the extraction and processing of minerals.Mining & metal processingPubChem
CEDs000701Ventilation Of Mines Or Tunnels?Ventilation in mines or tunnels is essential for maintaining air quality and ensuring the safety of workers.Mining & metal processingPubChem
CEDs000727Printing Machines Or Presses?Printing machines or presses commonly utilize synthetic chemicals such as inks, solvents, and cleaning agents.Paper, pulp & fiber productsPubChem
CEDs000730Contact Lens Cases?Contact lens cases are small containers designed to store contact lenses in a sterile environment, typically made from various synthetic materials including plastics such as polypropylene or polycarbonate.Healthcare, pharmaceuticals & veterinary productsPubChem
CEDs000734Coating Compositions?Coating compositions, which include paints, sealants, and varnishes, are formulated with a variety of synthetic chemicals such as solvents, resins, pigments, and additives.Building & ConstructionPubChem
CEDs000735Explosives?Explosives are chemical compounds or mixtures designed to undergo rapid decomposition, releasing energy in the form of gas and heat.Defense & military infrastructurePubChem
CEDs000736Fuses?Fuses are safety devices designed to protect electrical circuits by breaking the circuit when excessive current flows through.Electrical & Electronic EquipmentPubChem
CEDs000737Chemical Igniters?Chemical igniters are substances or devices designed to initiate combustion in various applications, often found in products like lighters, candles, and certain household cleaning agents.Household itemsPubChem
CEDs000738Cooling Circuit Water?Cooling circuit water is utilized in various industrial processes to absorb and dissipate heat generated during operations.Industrial manufacturing & chemical processingPubChem
CEDs000739Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.Paper, pulp & fiber productsPubChem
CEDs000740Paper?Paper production involves the processing of wood fibers and the use of various chemicals, which can lead to synthetic chemical contamination.Paper, pulp & fiber productsPubChem
CEDs000741Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.Paper, pulp & fiber productsPubChem
CEDs000742Leather Tanning?Leather tanning is a process that transforms raw animal hides into durable leather through the application of various chemicals, including chromium salts, aldehydes, and vegetable tannins.Textiles, leather & furnishingsPubChem
CEDs000743Sludge Treatment?Sludge treatment involves the processing of waste materials generated from wastewater treatment plants, which often contain a variety of organic and inorganic substances.Wastewater, sanitation & biosolidsPubChem
CEDs000744Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.Wastewater, sanitation & biosolidsPubChem
CEDs02082Waste GasWaste management, landfill & incinerationPMC10303832
CEDs02255WaterAquatic systems & sedimentsPMC11570603
CEDs02269Natural WatersAquatic systems & sedimentsPMC10536054
CEDs02589AirAir, dust & atmospheric transportPMC9202949 , PMC5435304
CEDs02591AtmosphereAir, dust & atmospheric transportPMC11510875 , PMC10303832
CEDs02596Ambient AirAir, dust & atmospheric transportPMC9202949 , PMC9202949
CEDs02956CoalEnergy, oil & gasPMC13210670
CEDs02964Fuel OilEnergy, oil & gasPMC11739590
CEDs03009Waste WaterWastewater, sanitation & biosolidsPMC12228674
CEDs03362Li-S batteriesElectrical & Electronic EquipmentPMC11840547
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Cytochrome P450 1A2 structureClick to view 3D structureCytochrome P450 1A2P05177HumansPredicted (SEA)
Prediction Confidence Score
0.063
Applicability Domain
0.125 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
793
E-value
7784.69
Amine oxidase [flavin-containing] B structureClick to view 3D structureAmine oxidase [flavin-containing] BP27338HumansPredicted (SEA)
Prediction Confidence Score
0.063
Applicability Domain
0.077 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
315
E-value
7784.61
Alpha-2A adrenergic receptor structureClick to view 3D structureAlpha-2A adrenergic receptorP08913HumansPredicted (SEA)
Prediction Confidence Score
0.061
Applicability Domain
0.125 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
487
E-value
7784.69
Epidermal growth factor receptor structureClick to view 3D structureEpidermal growth factor receptorP00533HumansPredicted (SEA)
Prediction Confidence Score
0.059
Applicability Domain
0.125 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
1301
E-value
7784.69
Fructose-1,6-bisphosphatase 1 structureClick to view 3D structureFructose-1,6-bisphosphatase 1P09467HumansPredicted (SEA)
Prediction Confidence Score
0.058
Applicability Domain
0.074 Low confidence
Statistical Significance
0.9998
Supporting Reference Compounds
28
E-value
7783.21
Carbonic anhydrase 1 structureClick to view 3D structureCarbonic anhydrase 1P00915HumansPredicted (SEA)
Prediction Confidence Score
0.058
Applicability Domain
0.111 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
407
E-value
7784.92
Click to view 3D structureCytochrome P450 2B1P00176RatPredicted (SEA)
Prediction Confidence Score
0.057
Applicability Domain
0.143 Low confidence
Statistical Significance
0.9877
Supporting Reference Compounds
8
E-value
7688.86
Aldehyde dehydrogenase 1A1 structureClick to view 3D structureAldehyde dehydrogenase 1A1P00352HumansPredicted (SEA)
Prediction Confidence Score
0.056
Applicability Domain
0.069 Low confidence
Statistical Significance
0.9999
Supporting Reference Compounds
31
E-value
7783.83
Sodium-dependent serotonin transporter structureClick to view 3D structureSodium-dependent serotonin transporterP31645HumansPredicted (SEA)
Prediction Confidence Score
0.055
Applicability Domain
0.125 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
593
E-value
7784.69
Cytochrome P450 2E1 structureClick to view 3D structureCytochrome P450 2E1P05181HumansPredicted (SEA)
Prediction Confidence Score
0.055
Applicability Domain
0.13 Low confidence
Statistical Significance
0.9997
Supporting Reference Compounds
31
E-value
7782.82
Protein arginine N-methyltransferase 1 structureClick to view 3D structureProtein arginine N-methyltransferase 1Q63009Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.055
Applicability Domain
0.057 Low confidence
Statistical Significance
0.8793
Supporting Reference Compounds
3
E-value
6845.28
Amine oxidase [flavin-containing] A structureClick to view 3D structureAmine oxidase [flavin-containing] AP21397HumansPredicted (SEA)
Prediction Confidence Score
0.055
Applicability Domain
0.077 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
241
E-value
7784.61
Gasdermin-D structureClick to view 3D structureGasdermin-DP57764HumansPredicted (SEA)
Prediction Confidence Score
0.054
Applicability Domain
0.056 Low confidence
Statistical Significance
0.1841
Supporting Reference Compounds
2
E-value
1433.05
Gasdermin-D structureClick to view 3D structureGasdermin-DQ9D8T2Mus musculusPredicted (SEA)
Prediction Confidence Score
0.054
Applicability Domain
0.056 Low confidence
Statistical Significance
0.1841
Supporting Reference Compounds
2
E-value
1433.05
Alpha-2C adrenergic receptor structureClick to view 3D structureAlpha-2C adrenergic receptorP18825HumansPredicted (SEA)
Prediction Confidence Score
0.054
Applicability Domain
0.125 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
386
E-value
7784.69
Adenosine receptor A3 structureClick to view 3D structureAdenosine receptor A3P0DMS8HumansPredicted (SEA)
Prediction Confidence Score
0.054
Applicability Domain
0.125 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
391
E-value
7784.69
Cytochrome P450 2A6 structureClick to view 3D structureCytochrome P450 2A6P11509HumansPredicted (SEA)
Prediction Confidence Score
0.054
Applicability Domain
0.13 Low confidence
Statistical Significance
0.9999
Supporting Reference Compounds
68
E-value
7784.38
Replicase polyprotein 1ab structureClick to view 3D structureReplicase polyprotein 1abP0DTD1SARS-CoV-2Predicted (SEA)
Prediction Confidence Score
0.053
Applicability Domain
0.063 Low confidence
Statistical Significance
1.0
Supporting Reference Compounds
215
E-value
7784.69
Click to view 3D structureCarbamate kinaseO97438Giardia intestinalisPredicted (SEA)
Prediction Confidence Score
0.053
Applicability Domain
0.053 Low confidence
Statistical Significance
0.2273
Supporting Reference Compounds
1
E-value
1769.36
Leukocyte immunoglobulin-like receptor subfamily B member 4 structureClick to view 3D structureLeukocyte immunoglobulin-like receptor subfamily B member 4Q8NHJ6HumansKnownNot Available
Macrophage migration inhibitory factor structureClick to view 3D structureMacrophage migration inhibitory factorP14174HumansPredicted (SEA)
Prediction Confidence Score
0.138
Applicability Domain
0.176 Low confidence
Statistical Significance
0.7232
Supporting Reference Compounds
36
E-value
5630.37
Transient receptor potential cation channel subfamily A member 1 structureClick to view 3D structureTransient receptor potential cation channel subfamily A member 1O75762HumansPredicted (SEA)
Prediction Confidence Score
0.105
Applicability Domain
0.176 Low confidence
Statistical Significance
0.998
Supporting Reference Compounds
70
E-value
7769.04
N-acylethanolamine-hydrolyzing acid amidase structureClick to view 3D structureN-acylethanolamine-hydrolyzing acid amidaseQ02083HumansPredicted (SEA)
Prediction Confidence Score
0.091
Applicability Domain
0.15 Low confidence
Statistical Significance
0.9917
Supporting Reference Compounds
15
E-value
7720.62
Lymphotoxin-alpha structureClick to view 3D structureLymphotoxin-alphaP01374HumansPredicted (SEA)
Prediction Confidence Score
0.091
Applicability Domain
0.091 Low confidence
Statistical Significance
0.1643
Supporting Reference Compounds
1
E-value
1278.91
Monoglyceride lipase structureClick to view 3D structureMonoglyceride lipaseQ99685HumansPredicted (SEA)
Prediction Confidence Score
0.082
Applicability Domain
0.15 Low confidence
Statistical Significance
0.9997
Supporting Reference Compounds
76
E-value
7782.82
Click to view 3D structureGMP synthase [glutamine-hydrolyzing]Q3THK7Mus musculusPredicted (SEA)
Prediction Confidence Score
0.073
Applicability Domain
0.073 Low confidence
Statistical Significance
0.895
Supporting Reference Compounds
1
E-value
6967.43
Cytochrome P450 1A1 structureClick to view 3D structureCytochrome P450 1A1P04798HumansKnownCarbon disulfide inhibits CYP1A1. (A539)
Cytochrome P450 2E1 structureClick to view 3D structureCytochrome P450 2E1P05181HumansKnownCarbon disulfide inhibits CYP2E1. (A539)
Dopamine beta-hydroxylase structureClick to view 3D structureDopamine beta-hydroxylaseP09172HumansKnownA primary effect of CS2 exposure is the inhibition of dopamine-beta-hydroxylase (DBH). The ability of CS2 to react with endogenous amines has led to the hypothesis that inhibition of DBH may occur via the formation of dithiocarbamate metabolites which bind to enzymic copper. (A209)
Concentrations
Not Available
External Links
DrugBank IDNot Available
HMDB IDHMDB0036574
FooDB IDFDB015482
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkCarbon disulfide
Chemspider ID6108
ChEBI ID23012
PubChem Compound ID6348
Kegg Compound IDC19033
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSLink
General References
  1. Sams C, Loizou GD, Cocker J, Lennard MS: Metabolism of ethylbenzene by human liver microsomes and recombinant human cytochrome P450s (CYP). Toxicol Lett. 2004 Mar 7;147(3):253-60. [PubMed: 15104117]
  2. Haritos VS, Dojchinov G: Carbonic anhydrase metabolism is a key factor in the toxicity of CO2 and COS but not CS2 toward the flour beetle Tribolium castaneum [Coleoptera: Tenebrionidae]. Comp Biochem Physiol C Toxicol Pharmacol. 2005 Jan;140(1):139-47. [PubMed: 15792633]
  3. Masuda Y, Yasoshima M, Nakayama N: Early, selective and reversible suppression of cytochrome P-450-dependent monooxygenase of liver microsomes following the administration of low doses of carbon disulfide in mice. Biochem Pharmacol. 1986 Nov 15;35(22):3941-7. [PubMed: 3778518]
  4. Ryle MJ, Lee HI, Seefeldt LC, Hoffman BM: Nitrogenase reduction of carbon disulfide: freeze-quench EPR and ENDOR evidence for three sequential intermediates with cluster-bound carbon moieties. Biochemistry. 2000 Feb 8;39(5):1114-9. [PubMed: 10653657]
  5. Seefeldt LC, Rasche ME, Ensign SA: Carbonyl sulfide and carbon dioxide as new substrates, and carbon disulfide as a new inhibitor, of nitrogenase. Biochemistry. 1995 Apr 25;34(16):5382-9. [PubMed: 7727396]
  6. Lam CW, DiStefano V: Characterization of carbon disulfide binding in blood and to other biological substances. Toxicol Appl Pharmacol. 1986 Nov;86(2):235-42. [PubMed: 3787622]
  7. Schreiner E, Freundt KJ: Behaviour of epoxide hydrolase, glutathione S-transferase, alcohol dehydrogenase, and aldehyde dehydrogenase, respectively, under the influence of carbon disulfide studies with rats in vivo and in vitro. G Ital Med Lav. 1984 May-Jul;6(3-4):131-3. [PubMed: 6242047]
  8. ATSDR - Agency for Toxic Substances and Disease Registry (1996). Toxicological profile for carbon disulfide. U.S. Public Health Service in collaboration with U.S. Environmental Protection Agency (EPA). - http://www.atsdr.cdc.gov/toxprofiles/tp82.html
  9. International Programme on Chemical Safety (IPCS) INCHEM (2000). Poison Information Monograph for Carbon Disulfide. - http://www.inchem.org/documents/icsc/icsc/eics0022.htm
  10. Thompson TS and Vorster SJ (2000). Attempted suicide by ingestion of methoxychlor. J Anal Toxicol 24:377-380.
  11. Rumack BH (2009). POISINDEX(R) Information System. Englewood, CO: Micromedex, Inc. CCIS Volume 141, edition expires Aug, 2009.
  12. Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.