Browsing CypCompounds in CypBoM Testing Set

*Bonds of Metabolism (BoMs) are listed for each cytochrome P450 (CYP) enzyme

Displaying compounds 51 - 73 of 73 in total
CypComp ID Name Structure ImageCYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
CC02530NimodipineUiagmcdksxebjq uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <7,2;Oxidation;R1>
  • <2,3;Reduction;R1>
  • <3,4;Oxidation;R1>
  • <4,5;Oxidation;R1>
  • <5,6;Reduction;R1>
  • <6,7;Oxidation;R1>
  • <30,29;Cleavage;R2>
  • <30,H;Oxidation;R2>
  • (show allshow less)
CC02531NisoldipineVkqfcgnpdricfg uhfffaoysa n
  • <7,2;Oxidation;R1>
  • <2,3;Reduction;R1>
  • <3,4;Oxidation;R1>
  • <4,5;Oxidation;R1>
  • <5,6;Reduction;R1>
  • <6,7;Oxidation;R1>
  • (show allshow less)
  • Not Available
  • Not Available
  • Not Available
  • <7,2;Oxidation;R1>
  • <2,3;Reduction;R1>
  • <3,4;Oxidation;R1>
  • <4,5;Oxidation;R1>
  • <5,6;Reduction;R1>
  • <6,7;Oxidation;R1>
  • (show allshow less)
  • <7,2;Oxidation;R1>
  • <2,3;Reduction;R1>
  • <3,4;Oxidation;R1>
  • <4,5;Oxidation;R1>
  • <5,6;Reduction;R1>
  • <6,7;Oxidation;R1>
  • (show allshow less)
  • <7,2;Oxidation;R1>
  • <2,3;Reduction;R1>
  • <3,4;Oxidation;R1>
  • <4,5;Oxidation;R1>
  • <5,6;Reduction;R1>
  • <6,7;Oxidation;R1>
  • (show allshow less)
  • <7,2;Oxidation;R1>
  • <2,3;Reduction;R1>
  • <3,4;Oxidation;R1>
  • <4,5;Oxidation;R1>
  • <5,6;Reduction;R1>
  • <6,7;Oxidation;R1>
  • (show allshow less)
  • <7,2;Oxidation;R1>
  • <2,3;Reduction;R1>
  • <3,4;Oxidation;R1>
  • <4,5;Oxidation;R1>
  • <5,6;Reduction;R1>
  • <6,7;Oxidation;R1>
  • (show allshow less)
CC02532N-NitrosonornicotineXkabjyqdmjtngq secbinfhsa n
  • Not Available
  • <8,2;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <5,2;Cleavage;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
CC02533MedifoxamineQnmghbmgnrqpnl uhfffaoysa n
  • Not Available
  • <6,3;Cleavage;R1>
  • <6,H;Oxidation;R1>
  • <7,3;Cleavage;R2>
  • <7,H;Oxidation;R2>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <6,3;Cleavage;R1>
  • <6,H;Oxidation;R1>
  • <7,3;Cleavage;R2>
  • <7,H;Oxidation;R2>
CC02534RitonavirNcdncnxcdxhomx xgkfqtdjsa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <40,11;Cleavage;R1>
  • <40,H;Oxidation;R1>
  • <46,H;Hydroxylation;R2>
  • Not Available
  • <40,11;Cleavage;R1>
  • <40,H;Oxidation;R1>
  • <9,29;Cleavage;R2>
  • <46,H;Hydroxylation;R3>
  • <39,11;Cleavage;R4>
CC02536FormoterolBpzsycziittybl yjymszousa n
  • Not Available
  • <25,2;Cleavage;R1>
  • <25,H;Oxidation;R1>
  • Not Available
  • Not Available
  • <25,2;Cleavage;R1>
  • <25,H;Oxidation;R1>
  • <25,2;Cleavage;R1>
  • <25,H;Oxidation;R1>
  • <25,2;Cleavage;R1>
  • <25,H;Oxidation;R1>
  • Not Available
  • Not Available
CC02537LetrozoleHpjkciuczwxjdr uhfffaoysa n
  • Not Available
  • <6,1;Cleavage;R1>
  • <6,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <6,1;Cleavage;R1>
  • <6,H;Oxidation;R1>
CC02538MethoxyfluraneRfkmcnohbtxsmu uhfffaoysa n
  • <8,5;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,5;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,5;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • <8,5;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,5;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,5;Cleavage;R1>
  • <8,H;Oxidation;R1>
CC02539SevofluraneDfeyyrmxojxzrj uhfffaoysa n
  • Not Available
  • <12,8;Cleavage;R1>
  • <12,H;Oxidation;R1>
  • <12,8;Cleavage;R1>
  • <12,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <12,8;Cleavage;R1>
  • <12,H;Oxidation;R1>
  • <12,8;Cleavage;R1>
  • <12,H;Oxidation;R1>
CC02540AsunaprevirXrwszzjlzrkhhd wvwijvsjsa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <51,11;Cleavage;R1>
  • <51,H;Oxidation;R1>
CC02541BrinzolamideHcrkczrjwpkoar jtqlqieisa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <20,10;Cleavage;R1>
  • <20,H;Oxidation;R1>
  • <16,9;Cleavage;R2>
  • <16,H;Oxidation;R2>
CC02542PrimaquineIndbqlzjxzlfit llvkdonjsa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <10,3;Cleavage;R1>
  • <10,H;Oxidation;R1>
CC02543DesmethylselegilineUufajpmqsfxdfr llvkdonjsa n
  • Not Available
  • <8,1;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <8,1;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <8,1;Cleavage;R1>
  • <8,H;Oxidation;R1>
CC02544CinnarizineDerzblkqocdddz jlhyyagusa n
  • <8,2;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <5,1;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <8,2;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <5,1;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <21,H;Hydroxylation;R1>
  • <22,H;Hydroxylation;R2>
  • Not Available
  • <8,2;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • <5,1;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • Not Available
  • <28,H;Hydroxylation;R1>
  • Not Available
  • Not Available
CC02545FlunarizineSmanxxcatutddt qpjjxvbhsa n
  • <7,3;Cleavage;R1>
  • <7,H;Oxidation;R1>
  • <10,4;Cleavage;R2>
  • <10,H;Oxidation;R2>
  • <7,3;Cleavage;R1>
  • <7,H;Oxidation;R1>
  • <10,4;Cleavage;R2>
  • <10,H;Oxidation;R2>
  • Not Available
  • Not Available
  • <7,3;Cleavage;R1>
  • <7,H;Oxidation;R1>
  • <10,4;Cleavage;R2>
  • <10,H;Oxidation;R2>
  • Not Available
  • <30,H;Hydroxylation;R1>
  • Not Available
  • Not Available
CC02546AlvamelineRnmomkcrcirycz uhfffaoysa n
  • <11,1;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <1,N;N-Oxidation;R2>
  • <11,1;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • <11,1;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <1,N;N-Oxidation;R2>
  • <13,2;Cleavage;R1>
  • <13,H;Oxidation;R1>
  • Not Available
  • <11,1;Cleavage;R1>
  • <11,H;Oxidation;R1>
CC02547AmidopyrineRmmxtbmqsgexhj uhfffaoysa n
  • <11,4;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <12,4;Cleavage;R2>
  • <12,H;Oxidation;R2>
  • Not Available
  • Not Available
  • <11,4;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <12,4;Cleavage;R2>
  • <12,H;Oxidation;R2>
  • <11,4;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <12,4;Cleavage;R2>
  • <12,H;Oxidation;R2>
  • <11,4;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <12,4;Cleavage;R2>
  • <12,H;Oxidation;R2>
  • <11,4;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <12,4;Cleavage;R2>
  • <12,H;Oxidation;R2>
  • Not Available
  • <11,4;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <12,4;Cleavage;R2>
  • <12,H;Oxidation;R2>
CC02548EnzalutamideWxcxuhsoupdcqv uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • <32,10;Cleavage;R1>
  • <32,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <32,10;Cleavage;R1>
  • <32,H;Oxidation;R1>
CC02549AcotiamideTwhznaubxfzmca uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • <31,4;Cleavage;R1>
  • <31,H;Oxidation;R1>
  • <30,3;Cleavage;R2>
  • <30,H;Oxidation;R2>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <31,4;Cleavage;R1>
  • <31,H;Oxidation;R1>
  • <30,3;Cleavage;R2>
  • <30,H;Oxidation;R2>
CC02550IsofluranePiwkpbjckxdkjr pvqjckrusa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <8,1;Cleavage;R1>
  • <8,H;Oxidation;R1>
  • Not Available
CC025511,2-DichloroethaneWsldoozrejycgb uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <4,2;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <3,1;Cleavage;R2>
  • <3,H;Oxidation;R2>
  • Not Available
CC02552IsopreneRrhgjuqnofwudk uhfffaoysa n
  • Not Available
  • Not Available
  • <3,5;EpOxidation;R1>
  • <1,4;EpOxidation;R2>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <3,5;EpOxidation;R1>
  • <1,4;EpOxidation;R2>
  • Not Available
CC02553Diethyl etherRtzkzfjdlaiyfh uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <3,1;Cleavage;R1>
  • <3,H;Oxidation;R1>
  • <2,1;Cleavage;R2>
  • <2,H;Oxidation;R2>
  • Not Available
Displaying compounds 51 - 73 of 73 in total