Showing CypComp Card for CC02450: Simvastatin (CypBoM Training Set)

Record Information
Version1.0
Creation Date2019-07-14 16:55:09 UTC
Last Updated2019-10-01 21:42:10 UTC
CypComp IDCC02450
Compound Information
NameSimvastatin
Structure ImageRymzzmvnjrmudd hgqwonqesa n
InChIKeyRYMZZMVNJRMUDD-HGQWONQESA-N
PubChem ID54454
CypCompound Information
SetCypBoM Training Set
Bonds of Metabolism (BoMs)
CYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <20,22;Dehydrogenation;R1>
  • <14,H;Hydroxylation;R2>
  • <20,21;Oxidation;R2>
  • <21,15;Reduction;R2>
  • <15,16;Oxidation;R2>
  • <16,14;Reduction;R2>
  • <14,H;Hydroxylation;R3>
  • <21,H;Hydroxylation;R3>
  • <21,15;Reduction;R3>
  • <15,16;Oxidation;R3>
  • <16,14;Reduction;R3>
References
  1. Prueksaritanont T, Gorham LM, Ma B, Liu L, Yu X, Zhao JJ, Slaughter DE, Arison BH, Vyas KP: In vitro metabolism of simvastatin in humans [SBT]identification of metabolizing enzymes and effect of the drug on hepatic P450s. Drug Metab Dispos. 1997 Oct;25(10):1191-9. [PubMed:9321523 ]
Download FileCC02450.sdf