Showing CypComp Card for CC02097: Butadiene (CypBoM Training Set)

Record Information
Version1.0
Creation Date2019-07-14 16:36:49 UTC
Last Updated2019-10-01 21:41:26 UTC
CypComp IDCC02097
Compound Information
NameButadiene
Structure ImageKakzbptyrlmsjv uhfffaoysa n
InChIKeyKAKZBPTYRLMSJV-UHFFFAOYSA-N
PubChem ID7845
CypCompound Information
SetCypBoM Training Set
Bonds of Metabolism (BoMs)
CYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
  • Not Available
  • <1,2;Epoxidation;R1>
  • <3,4;Epoxidation;R2>
  • Not Available
  • Not Available
  • <1,2;Epoxidation;R1>
  • <3,4;Epoxidation;R2>
  • Not Available
  • Not Available
  • <1,2;Epoxidation;R1>
  • <3,4;Epoxidation;R2>
  • Not Available
References
  1. Duescher RJ, Elfarra AA: Human liver microsomes are efficient catalysts of 1,3-butadiene oxidation: evidence for major roles by cytochromes P450 2A6 and 2E1. Arch Biochem Biophys. 1994 Jun;311(2):342-9. doi: 10.1006/abbi.1994.1246. [PubMed:8203896 ]
  2. Rendic S, Guengerich FP: Contributions of human enzymes in carcinogen metabolism. Chem Res Toxicol. 2012 Jul 16;25(7):1316-83. doi: 10.1021/tx300132k. Epub 2012 May 10. [PubMed:22531028 ]
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