Showing CypComp Card for CC02059: Toluene (CypBoM Training Set)

Record Information
Version1.0
Creation Date2019-07-14 16:36:34 UTC
Last Updated2019-10-01 21:41:21 UTC
CypComp IDCC02059
Compound Information
NameToluene
Structure ImageYxfvvabegxronw uhfffaoysa n
InChIKeyYXFVVABEGXRONW-UHFFFAOYSA-N
PubChem ID1140
CypCompound Information
SetCypBoM Training Set
Bonds of Metabolism (BoMs)
CYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
  • <3,H;Hydroxylation;R1>
  • <6,H;Hydroxylation;R2>
  • <1,H;Hydroxylation;R3>
  • <4,H;Hydroxylation;R4>
  • Not Available
  • <3,H;Hydroxylation;R1>
  • <6,H;Hydroxylation;R2>
  • <3,H;Hydroxylation;R1>
  • Not Available
  • Not Available
  • Not Available
  • <3,H;Hydroxylation;R1>
  • <6,H;Hydroxylation;R2>
  • Not Available
References
  1. Nakajima T, Wang RS, Elovaara E, Gonzalez FJ, Gelboin HV, Raunio H, Pelkonen O, Vainio H, Aoyama T: Toluene metabolism by cDNA-expressed human hepatic cytochrome P450. Biochem Pharmacol. 1997 Feb 7;53(3):271-7. doi: 10.1016/s0006-2952(96)00652-1. [PubMed:9065730 ]
Download FileCC02059.sdf