Taxol C (CED0000714)

Record Information
Version1.0
Creation Date2026-04-06 02:07:25 UTC
Update Date2026-08-22 14:58:10 UTC
Accession NumberCHEM114576
Identification
Common NameTaxol C
ClassSmall Molecule
Description
Taxol C is a chemical compound with the molecular formula C46H57NO14. Taxol C belongs to the diterpenoids, a subclass of prenol lipids within the organic compounds. With an average molecular weight of 847.96 g/mol, Taxol C is a heavy molecule. The compound has been identified in or released from 13 recorded sources across several diverse sectors. In the healthcare, pharmaceuticals, and veterinary products sector, it is associated with medical devices. Within the energy, oil, and gas sector as well as industrial manufacturing and chemical processing, it is found in lubricants. In the food, food processing, and cookware sector, it is linked to food packaging. In the textiles, leather, and furnishings sector, it is present in synthetic textiles and carpets and rugs. Additionally, it is found in electrical and electronic equipment, including cell phones, capacitors, wires and cables, batteries, and printed circuit boards, among one other item. One further sector has also been recorded as a source. Recorded exposure routes for Taxol C include inhalation, oral, and touch.
Contaminant Type
  • PFAS
  • Phytotoxin
Chemical Structure
SynonymsNot Available
Chemical FormulaC46H57NO14
Average Molecular Mass847.955 g/mol
Monoisotopic Mass847.378 g/mol
CAS Registry Number153415-45-3
IUPAC NameNot Available
Traditional NameNot Available
SMILESCCCCCC(=O)N[C@H]([C@@H](O)C(=O)O[C@H]1C[C@@]2(O)[C@@H](OC(=O)C3=CC=CC=C3)[C@@H]3[C@@]4(CO[C@@H]4C[C@H](O)[C@@]3(C)C(=O)[C@H](OC(C)=O)C(=C1C)C2(C)C)OC(C)=O)C1=CC=CC=C1
InChI IdentifierInChI=1S/C46H57NO14/c1-8-9-12-21-33(51)47-35(28-17-13-10-14-18-28)36(52)42(55)59-30-23-46(56)40(60-41(54)29-19-15-11-16-20-29)38-44(7,31(50)22-32-45(38,24-57-32)61-27(4)49)39(53)37(58-26(3)48)34(25(30)2)43(46,5)6/h10-11,13-20,30-32,35-38,40,50,52,56H,8-9,12,21-24H2,1-7H3,(H,47,51)/t30-,31-,32+,35-,36+,37+,38-,40-,44+,45-,46+/m0/s1
InChI KeyBEHTXUBGUDGCNQ-IEAAAIHOSA-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
8481.0Log mg/kg[4800:15000]RatLD50oralpredictedNot Available
Health Effects
Health EffectRelationshipDirectionReference
Exposure Sources
Source IDSourceSectorReference
7PesticidesAgriculture & land managementNot 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
Tyrosine-protein kinase Mer structureClick to view 3D structureTyrosine-protein kinase MerQ12866HumansPredicted (SEA)200.462
ATP-dependent translocase ABCB1 structureClick to view 3D structureATP-dependent translocase ABCB1P08183HumansPredicted (SEA)126.583
Proto-oncogene tyrosine-protein kinase Src structureClick to view 3D structureProto-oncogene tyrosine-protein kinase SrcP12931HumansPredicted (SEA)851.826
Ceramide transfer protein structureClick to view 3D structureCeramide transfer proteinQ9Y5P4HumansPredicted (SEA)8.09632
Click to view 3D structureNucleotide-binding oligomerization domain-containing protein 2Q9HC29HumansPredicted (SEA)51.7697
Tyrosine-protein kinase ABL1 structureClick to view 3D structureTyrosine-protein kinase ABL1P00519HumansPredicted (SEA)855.329
Fibroblast growth factor receptor 1 structureClick to view 3D structureFibroblast growth factor receptor 1P11362HumansPredicted (SEA)912.159
Click to view 3D structureNS3A3EZJ3Hepatitis C virusPredicted (SEA)21.7199
Cholecystokinin receptor type A structureClick to view 3D structureCholecystokinin receptor type AP32238HumansPredicted (SEA)149.081
Lysine-specific histone demethylase 1A structureClick to view 3D structureLysine-specific histone demethylase 1AO60341HumansPredicted (SEA)102.683
Cytochrome P450 3A4 structureClick to view 3D structureCytochrome P450 3A4P08684HumansPredicted (SEA)2329.87
Click to view 3D structureAlkaline ceramidase 2Q5QJU3HumansPredicted (SEA)34.1758
Click to view 3D structureBotulinum neurotoxin type AP0DPI0Clostridium botulinumPredicted (SEA)3.50322
Click to view 3D structureBeta tubulinQ25270Leishmania donovaniPredicted (SEA)0.233548
Click to view 3D structureSphingomyelinase CP11889Bacillus cereusPredicted (SEA)23.0434
Tubulin beta-3 chain structureClick to view 3D structureTubulin beta-3 chainQ13509HumansPredicted (SEA)1.79053
Interleukin-6 receptor subunit beta structureClick to view 3D structureInterleukin-6 receptor subunit betaP40189HumansPredicted (SEA)9.49761
Click to view 3D structureFe(3+)-Zn(2+) purple acid phosphataseP80366Phaseolus vulgarisPredicted (SEA)150.405
Click to view 3D structureHistone deacetylase 6Q99P97Rattus norvegicusPredicted (SEA)481.731
Growth hormone-releasing hormone receptor structureClick to view 3D structureGrowth hormone-releasing hormone receptorQ02643HumansPredicted (SEA)0.0778492
Substance-K receptor structureClick to view 3D structureSubstance-K receptorP21452HumansPredicted (SEA)24.289
Epidermal growth factor receptor structureClick to view 3D structureEpidermal growth factor receptorP00533HumansPredicted (SEA)211.983
Delta-type opioid receptor structureClick to view 3D structureDelta-type opioid receptorP41143HumansPredicted (SEA)411.044
Solute carrier organic anion transporter family member 1B1 structureClick to view 3D structureSolute carrier organic anion transporter family member 1B1Q9Y6L6HumansPredicted (SEA)17.7496
Solute carrier organic anion transporter family member 1B3 structureClick to view 3D structureSolute carrier organic anion transporter family member 1B3Q9NPD5HumansPredicted (SEA)14.2464
Concentrations
Not Available
External Links
IdentifiersNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General ReferencesNot Available