Showing CypComp Card for CC01977: MDE (CypBoM Training Set)

Record Information
Version1.0
Creation Date2019-07-14 16:36:06 UTC
Last Updated2019-10-01 21:41:10 UTC
CypComp IDCC01977
Compound Information
NameMDE
Structure ImagePvxvwwanjiwjoo vifpvbqesa n
InChIKeyPVXVWWANJIWJOO-VIFPVBQESA-N
PubChem ID13909090
CypCompound Information
SetCypBoM Training Set
Bonds of Metabolism (BoMs)
CYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
  • <8,6;Cleavage;R1>
  • <8,4;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <14,12;Cleavage;R2>
  • <14,H;Oxidation;R2>
  • Not Available
  • <8,6;Cleavage;R1>
  • <8,4;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <14,12;Cleavage;R2>
  • <14,H;Oxidation;R2>
  • <8,6;Cleavage;R1>
  • <8,4;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,6;Cleavage;R1>
  • <8,4;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • Not Available
  • <8,6;Cleavage;R1>
  • <8,4;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,6;Cleavage;R1>
  • <8,4;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,6;Cleavage;R1>
  • <8,4;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <14,12;Cleavage;R2>
  • <14,H;Oxidation;R2>
References
  1. Kreth K, Kovar K, Schwab M, Zanger UM: Identification of the human cytochromes P450 involved in the oxidative metabolism of "Ecstasy"-related designer drugs. Biochem Pharmacol. 2000 Jun 15;59(12):1563-71. doi: 10.1016/s0006-2952(00)00284-7. [PubMed:10799653 ]
Download FileCC01977.sdf