Showing CypComp Card for CC01838: Carbamazepine (CypBoM Training Set)

Record Information
Version1.0
Creation Date2019-07-14 16:35:10 UTC
Last Updated2019-10-01 21:40:53 UTC
CypComp IDCC01838
Compound Information
NameCarbamazepine
Structure ImageFfgptbgblshepo uhfffaoysa n
InChIKeyFFGPTBGBLSHEPO-UHFFFAOYSA-N
PubChem ID2554
CypCompound Information
SetCypBoM Training Set
Bonds of Metabolism (BoMs)
CYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
  • <16,H;Hydroxylation;R1>
  • <18,H;Hydroxylation;R2>
  • <13,H;Hydroxylation;R3>
  • <17,H;Hydroxylation;R4>
  • <16,H;Hydroxylation;R1>
  • <18,H;Hydroxylation;R2>
  • <13,H;Hydroxylation;R3>
  • <17,H;Hydroxylation;R4>
  • <16,H;Hydroxylation;R1>
  • <18,H;Hydroxylation;R2>
  • <13,H;Hydroxylation;R3>
  • <17,H;Hydroxylation;R4>
  • <15,12;EpOxidation;R1>
  • <16,H;Hydroxylation;R2>
  • <18,H;Hydroxylation;R3>
  • <13,H;Hydroxylation;R4>
  • <17,H;Hydroxylation;R5>
  • Not Available
  • Not Available
  • <16,H;Hydroxylation;R1>
  • <18,H;Hydroxylation;R2>
  • <13,H;Hydroxylation;R3>
  • <17,H;Hydroxylation;R4>
  • <16,H;Hydroxylation;R1>
  • <18,H;Hydroxylation;R2>
  • <13,H;Hydroxylation;R3>
  • <17,H;Hydroxylation;R4>
  • <15,12;EpOxidation;R1>
  • <16,H;Hydroxylation;R2>
  • <18,H;Hydroxylation;R3>
  • <13,H;Hydroxylation;R4>
  • <17,H;Hydroxylation;R5>
References
  1. Pearce RE, Vakkalagadda GR, Leeder JS: Pathways of carbamazepine bioactivation in vitro I. Characterization of human cytochromes P450 responsible for the formation of 2- and 3-hydroxylated metabolites. Drug Metab Dispos. 2002 Nov;30(11):1170-9. doi: 10.1124/dmd.30.11.1170. [PubMed:12386121 ]
  2. Parkinson A (2001). Biotransformation of xenobiotics. In Casarett and Doull's Toxicology: The Basic Science of Poisons (6th ed., pp. 172). New York: McGraw-Hill Education / Medical. [ISBN:9780071347211 ]
Download FileCC01838.sdf