(6as,11br)-7,11b-dihydro-6h-indeno[2,1-c]chromene-3,4,6a,9,10-pentol (CED0252017)

Record Information
Version1.0
Creation Date2026-08-28 17:40:56 UTC
Update Date2026-08-28 17:40:56 UTC
SynCED IDCED0252017
Secondary Accession Numbers
  • CHEM296651
Identification
Common Name(6as,11br)-7,11b-dihydro-6h-indeno[2,1-c]chromene-3,4,6a,9,10-pentol
ClassSmall Molecule
Description
(6as,11br)-7,11b-dihydro-6h-indeno[2,1-c]chromene-3,4,6a,9,10-pentol belongs to the 1-benzopyrans, a subclass of benzopyrans within the organic compounds. This organoheterocyclic compound has the chemical formula C16H14O6 and an average molecular weight of 302.28 g/mol. It has been identified in one recorded source, where it was found in or released from electrical and electronic equipment, specifically television systems.
Contaminant TypeNot Available
Chemical Structure
SynonymsNot Available
Chemical FormulaC16H14O6
Average Molecular MassNot Available
Monoisotopic Mass302.079 g/mol
CAS Registry Number517-28-2
IUPAC NameNot Available
Traditional NameNot Available
SMILESC1C2=CC(=C(C=C2C3C1(COC4=C3C=CC(=C4O)O)O)O)O
InChI IdentifierInChI=1S/C16H14O6/c17-10-2-1-8-13-9-4-12(19)11(18)3-7(9)5-16(13,21)6-22-15(8)14(10)20/h1-4,13,17-21H,5-6H2/t13-,16+/m0/s1
InChI KeyWZUVPPKBWHMQCE-XJKSGUPXSA-N
Chemical Taxonomy
ClassificationNot classified
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Organoleptic EffectsNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted PropertiesNot Available
Spectra
SpectraNot Available
Toxicity Profile
Toxicity Values
Toxicity ValueOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalToxicity RatingReference
882.0 Log mg/kg [500:1600]RatLD50oralpredictedNot AvailableNot Available
Toxicity / Toxin ClassNot Available
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Health Effects
Health EffectRelationshipDirectionReference
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 managementNot Available
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 & cosmeticsNot Available
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 EquipmentNot Available
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 EquipmentNot Available
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 EquipmentNot Available
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 & cookwareNot Available
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 productsNot Available
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 processingNot Available
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 managementNot Available
CEDs000604Pest Attractants?Pest attractants are synthetic chemicals designed to lure specific pests for monitoring or control purposes.Agriculture & land managementNot Available
CEDs000609Aftershave?Aftershave is a grooming product typically used to soothe and protect the skin following shaving.Personal care & cosmeticsNot Available
CEDs000610Aftersun Products?Aftersun products are designed to soothe and hydrate the skin after sun exposure, often containing various synthetic chemicals such as emollients, preservatives, and fragrances.Personal care & cosmeticsNot Available
CEDs000611Anti Perspirants Or Body Deoderants?Antiperspirants and body deodorants commonly contain synthetic chemicals such as aluminum compounds, parabens, and synthetic fragrances.Personal care & cosmeticsNot Available
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 & cosmeticsNot Available
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 & cosmeticsNot Available
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 & cosmeticsNot Available
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 & cosmeticsNot Available
CEDs000632Apparel?Apparel production often involves the use of various synthetic chemicals, including dyes, finishing agents, and preservatives.Textiles, leather & furnishingsNot Available
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 managementNot Available
CEDs000679Phosphatic Fertilisers?Phosphatic fertilizers are synthetic chemical products primarily composed of phosphorus, which is essential for plant growth.Agriculture & land managementNot Available
CEDs000685Ceramics?Ceramics can be a source of synthetic chemical contamination through various additives and processing agents used in their production.Building & ConstructionNot Available
CEDs000693Silica Glass?Silica glass, primarily composed of silicon dioxide (SiO2), is widely used in various applications, including windows, glass facades, and insulation materials.Building & ConstructionNot Available
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 processingNot Available
CEDs000703Blackboards?Blackboards, traditionally made from slate or coated wood, can also be produced using synthetic materials that may contain various chemicals.Paper, pulp & fiber productsNot Available
CEDs000739Inks?Inks are complex mixtures composed of pigments or dyes, solvents, resins, and additives used primarily for printing and writing applications.Paper, pulp & fiber productsNot Available
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 productsNot Available
CEDs000741Pigment Pastes?Pigment pastes are concentrated dispersions of pigments used to impart color and properties to materials.Paper, pulp & fiber productsNot Available
CEDs000744Water, Wastewater, & Sewage Treatment?Water, wastewater, and sewage treatment processes are critical for managing and mitigating pollutants in water systems.Wastewater, sanitation & biosolidsNot Available
Pathways
0 pathwaysPathway Source: PathBank

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Proto-oncogene tyrosine-protein kinase Src structureClick to view 3D structureProto-oncogene tyrosine-protein kinase SrcP12931HumansPredicted (SEA)
Prediction Confidence Score
0.39
Applicability Domain
1.0
Statistical Significance
0.0314
Supporting Reference Compounds
1158
E-value
244.68
Vascular endothelial growth factor receptor 2 structureClick to view 3D structureVascular endothelial growth factor receptor 2P35968HumansPredicted (SEA)
Prediction Confidence Score
0.386
Applicability Domain
1.0
Statistical Significance
0.04
Supporting Reference Compounds
1660
E-value
311.63
Hepatocyte growth factor receptor structureClick to view 3D structureHepatocyte growth factor receptorP08581HumansPredicted (SEA)
Prediction Confidence Score
0.386
Applicability Domain
1.0
Statistical Significance
0.0226
Supporting Reference Compounds
934
E-value
176.095
Fibroblast growth factor receptor 1 structureClick to view 3D structureFibroblast growth factor receptor 1P11362HumansPredicted (SEA)
Prediction Confidence Score
0.383
Applicability Domain
1.0
Statistical Significance
0.0286
Supporting Reference Compounds
1010
E-value
222.493
Replicase polyprotein 1ab structureClick to view 3D structureReplicase polyprotein 1abP0DTD1SARS-CoV-2Predicted (SEA)
Prediction Confidence Score
0.379
Applicability Domain
1.0
Statistical Significance
0.0053
Supporting Reference Compounds
215
E-value
41.3379
Mast/stem cell growth factor receptor Kit structureClick to view 3D structureMast/stem cell growth factor receptor KitP10721HumansPredicted (SEA)
Prediction Confidence Score
0.376
Applicability Domain
1.0
Statistical Significance
0.0304
Supporting Reference Compounds
905
E-value
236.895
Replicase polyprotein 1ab structureClick to view 3D structureReplicase polyprotein 1abK9N7C7Middle East respiratory syndrome-related coronavirus (isolate United Kingdom/H123990006/2012)Predicted (SEA)
Prediction Confidence Score
0.369
Applicability Domain
1.0
Statistical Significance
5.00e-05
Supporting Reference Compounds
48
E-value
0.389246
Large T antigen structureClick to view 3D structureLarge T antigenP03070Simian virus 40Predicted (SEA)
Prediction Confidence Score
0.369
Applicability Domain
1.0
Statistical Significance
5.30e-04
Supporting Reference Compounds
78
E-value
4.12601
Induced myeloid leukemia cell differentiation protein Mcl-1 structureClick to view 3D structureInduced myeloid leukemia cell differentiation protein Mcl-1Q07820HumansPredicted (SEA)
Prediction Confidence Score
0.361
Applicability Domain
1.0
Statistical Significance
0.0057
Supporting Reference Compounds
343
E-value
44.3741
Click to view 3D structureGlucose-6-phosphate dehydrogenase-6-phosphogluconolactonaseQ9BHT9Plasmodium bergheiPredicted (SEA)
Prediction Confidence Score
0.361
Applicability Domain
1.0
Statistical Significance
6.10e-04
Supporting Reference Compounds
105
E-value
4.7488
Epidermal growth factor receptor structureClick to view 3D structureEpidermal growth factor receptorP00533HumansPredicted (SEA)
Prediction Confidence Score
0.359
Applicability Domain
1.0
Statistical Significance
0.0495
Supporting Reference Compounds
1301
E-value
385.587
Vascular endothelial growth factor receptor 1 structureClick to view 3D structureVascular endothelial growth factor receptor 1P17948HumansPredicted (SEA)
Prediction Confidence Score
0.345
Applicability Domain
1.0
Statistical Significance
0.0372
Supporting Reference Compounds
711
E-value
289.366
Receptor tyrosine-protein kinase erbB-2 structureClick to view 3D structureReceptor tyrosine-protein kinase erbB-2P04626HumansPredicted (SEA)
Prediction Confidence Score
0.334
Applicability Domain
1.0
Statistical Significance
0.0428
Supporting Reference Compounds
674
E-value
332.883
Ephrin type-B receptor 2 structureClick to view 3D structureEphrin type-B receptor 2P29323HumansPredicted (SEA)
Prediction Confidence Score
0.3
Applicability Domain
1.0
Statistical Significance
0.0245
Supporting Reference Compounds
148
E-value
191.042
Fibrinogen beta chain structureClick to view 3D structureFibrinogen beta chainP02675HumansPredicted (SEA)
Prediction Confidence Score
0.273
Applicability Domain
1.0
Statistical Significance
1.00e-05
Supporting Reference Compounds
5
E-value
0.0778492
D(2) dopamine receptor structureClick to view 3D structureD(2) dopamine receptorP14416HumansPredicted (SEA)
Prediction Confidence Score
0.267
Applicability Domain
0.281 Low confidence
Statistical Significance
0.1954
Supporting Reference Compounds
1103
E-value
1521.33
D(4) dopamine receptor structureClick to view 3D structureD(4) dopamine receptorP21917HumansPredicted (SEA)
Prediction Confidence Score
0.266
Applicability Domain
0.281 Low confidence
Statistical Significance
0.1309
Supporting Reference Compounds
524
E-value
1018.97
D(1A) dopamine receptor structureClick to view 3D structureD(1A) dopamine receptorP21728HumansPredicted (SEA)
Prediction Confidence Score
0.265
Applicability Domain
0.281 Low confidence
Statistical Significance
0.0912
Supporting Reference Compounds
425
E-value
709.829
Click to view 3D structureD(2) dopamine receptorP61169RatPredicted (SEA)
Prediction Confidence Score
0.265
Applicability Domain
0.281 Low confidence
Statistical Significance
0.117
Supporting Reference Compounds
528
E-value
910.758
Click to view 3D structureD(1A) dopamine receptorP50130Sus scrofaPredicted (SEA)
Prediction Confidence Score
0.252
Applicability Domain
0.281 Low confidence
Statistical Significance
0.0334
Supporting Reference Compounds
35
E-value
260.094
Click to view 3D structureD(1A) dopamine receptorP18901Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.251
Applicability Domain
0.263 Low confidence
Statistical Significance
0.0741
Supporting Reference Compounds
206
E-value
576.785
D(1B) dopamine receptor structureClick to view 3D structureD(1B) dopamine receptorP21918HumansPredicted (SEA)
Prediction Confidence Score
0.246
Applicability Domain
0.281 Low confidence
Statistical Significance
0.0998
Supporting Reference Compounds
209
E-value
777.013
Click to view 3D structureD(1) dopamine receptorP35406Carassius auratusPredicted (SEA)
Prediction Confidence Score
0.244
Applicability Domain
0.263 Low confidence
Statistical Significance
6.00e-04
Supporting Reference Compounds
10
E-value
4.67095
Click to view 3D structureAdenylate cyclase type 5Q04400Rattus norvegicusPredicted (SEA)
Prediction Confidence Score
0.242
Applicability Domain
0.271 Low confidence
Statistical Significance
0.0015
Supporting Reference Compounds
8
E-value
11.5995
Alpha-2A adrenergic receptor structureClick to view 3D structureAlpha-2A adrenergic receptorP08913HumansPredicted (SEA)
Prediction Confidence Score
0.239
Applicability Domain
0.281 Low confidence
Statistical Significance
0.2359
Supporting Reference Compounds
487
E-value
1836.54
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available