Showing CypComp Card for CC01816: 4-Chloromethyl-7-ethoxycoumarin (CypBoM Training Set)

Record Information
Version1.0
Creation Date2019-07-14 16:35:03 UTC
Last Updated2019-10-01 21:40:50 UTC
CypComp IDCC01816
Compound Information
Name4-Chloromethyl-7-ethoxycoumarin
Structure ImageRwmrbnnwqluefx uhfffaoysa n
InChIKeyRWMRBNNWQLUEFX-UHFFFAOYSA-N
PubChem ID71339287
CypCompound Information
SetCypBoM Training Set
Bonds of Metabolism (BoMs)
CYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
  • Not Available
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
  • <5,H;Oxidation;R1>
  • <5,4;Cleavage;R1>
References
  1. Ekins S, Vandenbranden M, Ring BJ, Gillespie JS, Yang TJ, Gelboin HV, Wrighton SA: Further characterization of the expression in liver and catalytic activity of CYP2B6. J Pharmacol Exp Ther. 1998 Sep;286(3):1253-9. [PubMed:9732386 ]
Download FileCC01816.sdf