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Record Information
Version1.0
Creation Date2019-07-14 16:35:53 UTC
Last Updated2019-10-01 21:41:06 UTC
CypComp IDCC01942
Compound Information
NameEstrone
Structure ImageDnxheguupjumqt qyfvkbazsa n
InChIKeyDNXHEGUUPJUMQT-QYFVKBAZSA-N
PubChem ID133184
CypCompound Information
SetCypBoM Training Set
Bonds of Metabolism (BoMs)
CYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
  • <19,H;Hydroxylation;R1>
  • <18,H;Hydroxylation;R2>
  • Not Available
  • <19,H;Hydroxylation;R1>
  • <19,H;Hydroxylation;R1>
  • <11,H;Hydroxylation;R2>
  • <19,H;Hydroxylation;R1>
  • <18,H;Hydroxylation;R2>
  • <19,H;Hydroxylation;R1>
  • <19,H;Hydroxylation;R1>
  • Not Available
  • <19,H;Hydroxylation;R1>
  • <11,H;Hydroxylation;R2>
  • <15,H;Hydroxylation;R3>
  • <18,H;Hydroxylation;R4>
References
  1. Lee AJ, Cai MX, Thomas PE, Conney AH, Zhu BT: Characterization of the oxidative metabolites of 17beta-estradiol and estrone formed by 15 selectively expressed human cytochrome p450 isoforms. Endocrinology. 2003 Aug;144(8):3382-98. doi: 10.1210/en.2003-0192. [PubMed:12865317 ]
  2. Ohe T, Hirobe M, Mashino T: Novel metabolic pathway of estrone and 17beta-estradiol catalyzed by cytochrome P-450. Drug Metab Dispos. 2000 Feb;28(2):110-2. [PubMed:10640505 ]
Download FileCC01942.sdf