Jacobine N-oxide (CED0020734)

Record Information
Version1.0
Creation Date2026-04-05 10:23:13 UTC
Update Date2026-05-20 18:27:35 UTC
Accession NumberCHEM099183
Identification
Common NameJacobine N-oxide
ClassSmall Molecule
Description
Jacobine N-oxide is an organic compound with the formula C18H25NO7. Jacobine N-oxide belongs to the alkaloids and derivatives, a superclass within the organic compounds. This compound has been identified in or released from 14 recorded sources across multiple sectors. Within electrical and electronic equipment, it is found in capacitors, batteries, printed circuit boards, wires and cables, cell phones, and one additional source. It is also present in textiles, leather and furnishings, specifically within carpets, rugs, and synthetic textiles. Further sources include lubricants in the energy, oil and gas sector, medical devices in the healthcare, pharmaceuticals and veterinary products sector, and food packaging in the food, food processing and cookware sector. Additionally, the compound is found in drinking water and water supply, as well as two other sectors. Recorded routes of exposure for Jacobine N-oxide include oral, inhalation, and touch.
Contaminant Type
  • PFAS
Chemical Structure
SynonymsNot Available
Chemical FormulaC18H25NO7
Average Molecular MassNot Available
Monoisotopic MassNot Available
CAS Registry Number38710-25-7
IUPAC NameNot Available
Traditional NameNot Available
SMILESNot Available
InChI IdentifierInChI=1S/C18H25NO7/c1-10-8-18(11(2)26-18)16(21)25-13-5-7-19(23)6-4-12(14(13)19)9-24-15(20)17(10,3)22/h4,10-11,13-14,22H,5-9H2,1-3H3/t10-,11+,13-,14-,17-,18+,19?/m1/s1
InChI KeyNKRQJWQYBNTAEV-SAJQNFQWSA-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
Mechanism of ToxicityNot Available
Carcinogenicity (IARC Classification)Not Available
Minimum Risk LevelNot Available
SymptomsNot Available
TreatmentNot Available
Toxicity Values
Toxicity ValueUnitValue RangeOrganismDose DescriptorRoute of ExposurePredicted or ExperimentalReference
46.0Log mg/kg[30:82]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
7PesticidesAgriculture & land managementNot Available
115Drinking waterDrinking water & water supplyNot Available
120Wires and cablesElectrical & Electronic EquipmentNot Available
121Printed circuit boardsElectrical & Electronic EquipmentNot Available
125BatteriesElectrical & Electronic EquipmentNot Available
130SemiconductorsElectrical & Electronic EquipmentNot Available
138LubricantsEnergy, oil & gasNot Available
147Food packagingFood, food processing & cookwareNot Available
174LubricantsIndustrial manufacturing & chemical processingNot Available
234Medical devicesHealthcare, pharmaceuticals & veterinary productsNot Available
451Carpets and RugsTextiles, leather & furnishingsNot Available
454Synthetic textilesTextiles, leather & furnishingsNot Available
490Personal care & cosmeticsNot Available
492Cell phonesElectrical & Electronic EquipmentNot Available
493CapacitorsElectrical & Electronic EquipmentNot Available
Pathways
0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets
StructureProteinUniProt IDOrganismRelationshipDetails
Click to view 3D structureGlycine receptor subunit alpha-2P22771Rattus norvegicusPredicted (SEA)0.389246
Click to view 3D structureSerine/threonine-protein phosphatase 2A 65 kDa regulatory subunit A alpha isoformQ76MZ3Mus musculusPredicted (SEA)1.32344
Click to view 3D structureNeurogenic locus notch homolog protein 1Q01705Mus musculusPredicted (SEA)16.0369
Click to view 3D structureAcidic phospholipase A2 2P15445Naja najaPredicted (SEA)2.56902
Click to view 3D structureFumarate reductaseF1KRD8Ascaris suumPredicted (SEA)0.778492
Click to view 3D structureSodium/potassium-transporting ATPase subunit alpha-1P05024Sus scrofaPredicted (SEA)4.20386
Phospholipase A2, membrane associated structureClick to view 3D structurePhospholipase A2, membrane associatedP14555HumansPredicted (SEA)2822.27
Signal transducer and activator of transcription 3 structureClick to view 3D structureSignal transducer and activator of transcription 3P40763HumansPredicted (SEA)5791.98
Tyrosine-protein phosphatase non-receptor type 1 structureClick to view 3D structureTyrosine-protein phosphatase non-receptor type 1P18031HumansPredicted (SEA)4970.98
Click to view 3D structureTranscriptional activator MybP01103Gallus gallusPredicted (SEA)11.1324
Glucocorticoid receptor structureClick to view 3D structureGlucocorticoid receptorP04150HumansPredicted (SEA)6209.33
Progesterone receptor structureClick to view 3D structureProgesterone receptorP06401HumansPredicted (SEA)6425.67
Click to view 3D structureEukaryotic initiation factor 4A-IP60843Mus musculusPredicted (SEA)13.3901
Click to view 3D structureProstaglandin reductase 1P97584Rattus norvegicusPredicted (SEA)15.1027
Vascular endothelial growth factor receptor 2 structureClick to view 3D structureVascular endothelial growth factor receptor 2P35968HumansPredicted (SEA)7674.38
Click to view 3D structureProgesterone receptorQ690N0Bos taurusPredicted (SEA)828.705
Click to view 3D structureAndrogen receptorP15207Rattus norvegicusPredicted (SEA)3108.05
Click to view 3D structurePhospholipase A2P00630Apis melliferaPredicted (SEA)35.4214
Click to view 3D structureTegument protein VP16P06492Herpes simplex virus (type 1 / strain 17)Predicted (SEA)6200.15
Photoreceptor-specific nuclear receptor structureClick to view 3D structurePhotoreceptor-specific nuclear receptorQ9Y5X4HumansPredicted (SEA)6414.46
Androgen receptor structureClick to view 3D structureAndrogen receptorP10275HumansPredicted (SEA)6829.25
Sex hormone-binding globulin structureClick to view 3D structureSex hormone-binding globulinP04278HumansPredicted (SEA)361.687
Estrogen receptor structureClick to view 3D structureEstrogen receptorP03372HumansPredicted (SEA)7125.38
Mineralocorticoid receptor structureClick to view 3D structureMineralocorticoid receptorP08235HumansPredicted (SEA)5985.28
High affinity nerve growth factor receptor structureClick to view 3D structureHigh affinity nerve growth factor receptorP04629HumansPredicted (SEA)7625.72
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available