Browsing CypCompounds in CypBoM Training Set

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

Displaying compounds 201 - 225 of 679 in total
CypComp ID Name Structure ImageCYP1A2CYP2A6CYP2B6CYP2C8CYP2C9CYP2C19CYP2D6CYP2E1CYP3A4
CC02331o-XyleneCtqngglpubdakn uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <1,H;Hydroxylation;R1>
  • <2,H;Hydroxylation;R2>
  • <3,H;Hydroxylation;R3>
  • <4,H;Hydroxylation;R4>
  • <6,H;Hydroxylation;R5>
  • <8,H;Hydroxylation;R6>
  • (show allshow less)
  • Not Available
CC02002o-PhenylphenolLlemowngbbnajr uhfffaoysa n
  • <9,H;Hydroxylation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
CC02006o-DichlorobenzeneRfflaflayfxfsw uhfffaoysa n
  • <1,H;Hydroxylation;R1>
  • <2,H;Hydroxylation;R2>
  • <3,H;Hydroxylation;R3>
  • <6,H;Hydroxylation;R4>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <1,H;Hydroxylation;R1>
  • <2,H;Hydroxylation;R2>
  • <3,H;Hydroxylation;R3>
  • <6,H;Hydroxylation;R4>
  • <1,H;Hydroxylation;R1>
  • <2,H;Hydroxylation;R2>
  • <3,H;Hydroxylation;R3>
  • <6,H;Hydroxylation;R4>
CC02001o-AminoazotoluenePfryfzzsecnqol wukndpdisa n
  • <7,H;Hydroxylation;R1>
  • <13,H;Hydroxylation;R2>
  • <16,H;Hydroxylation;R3>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
CC02425NS-21Dmepdnfrhugnpt xmmpixpasa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <25,24;Cleavage;R1>
  • <25,H;Oxidation;R1>
  • <26,24;Cleavage;R2>
  • <26,H;Oxidation;R2>
  • <18,H;Hydroxylation;R3>
CC02091NPYRWnyadzvdbibljj uhfffaoysa n
  • Not Available
  • <4,3;Cleavage;R1>
  • <4,H;Hydroxylation;R1>
  • <7,3;Cleavage;R2>
  • <7,H;Hydroxylation;R2>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <4,3;Cleavage;R1>
  • <4,H;Hydroxylation;R1>
  • <7,3;Cleavage;R2>
  • <7,H;Hydroxylation;R2>
  • Not Available
CC02221NorverapamilUpkqncpkpolass aremukbssa n
  • Not Available
  • Not Available
  • Not Available
  • <24,23;Cleavage;R1>
  • <24,H;Oxidation;R1>
  • <28,5;Cleavage;R2>
  • <28,H;Oxidation;R2>
  • Not Available
  • Not Available
  • <24,23;Cleavage;R1>
  • <24,H;Oxidation;R1>
  • <28,5;Cleavage;R2>
  • <28,H;Oxidation;R2>
  • Not Available
  • <24,23;Cleavage;R1>
  • <24,H;Oxidation;R1>
  • <28,5;Cleavage;R2>
  • <28,H;Oxidation;R2>
CC02000NortriptylinePhvgltmqbufiqq uhfffaoysa n
  • <20,19;Cleavage;R1>
  • <20,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <20,19;Cleavage;R1>
  • <20,H;Oxidation;R1>
  • <20,19;Cleavage;R1>
  • <20,H;Oxidation;R1>
  • <13,H;Hydroxylation;R2>
  • <10,H;Hydroxylation;R3>
  • Not Available
  • <13,H;Hydroxylation;R1>
  • <10,H;Hydroxylation;R2>
CC01999NordiazepamAkplhcdwdrpjgd uhfffaoysa n
  • <12,H;Hydroxylation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <12,H;Hydroxylation;R1>
  • Not Available
  • Not Available
  • <12,H;Hydroxylation;R1>
CC01998NordexfenfluramineMlbhfbkzuplwbd zetcqymhsa n
  • <9,H;Hydroxylation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
CC02145nor-LAAMVwcugcyzzgrkee dyesrhjhsa n
  • Not Available
  • Not Available
  • <20,13;Cleavage;R1>
  • <20,H;Oxidation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <20,13;Cleavage;R1>
  • <20,H;Oxidation;R1>
CC02220NO-1886Kprturmjvwxurq uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • <24,22;Cleavage;R1>
  • <24,H;Oxidation;R1>
  • <26,21;Cleavage;R2>
  • <26,H;Oxidation;R2>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <24,22;Cleavage;R1>
  • <24,H;Oxidation;R1>
  • <26,21;Cleavage;R2>
  • <26,H;Oxidation;R2>
CC01864NNKFlaqqshrlbfiez uhfffaoysa n
  • <11,12;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <13,H;Hydroxylation;R2>
  • <13,12;Cleavage;R2>
  • <12,11;Cleavage;R2>
  • <7,8;Cleavage;R3>
  • (show allshow less)
  • <11,12;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <13,H;Hydroxylation;R2>
  • <13,12;Cleavage;R2>
  • <12,11;Cleavage;R2>
  • <3,N;N-Oxidation;R3>
  • (show allshow less)
  • Not Available
  • <11,12;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <13,H;Hydroxylation;R2>
  • <13,12;Cleavage;R2>
  • <12,11;Cleavage;R2>
  • <3,N;N-Oxidation;R3>
  • (show allshow less)
  • <3,N;N-Oxidation;R1>
  • Not Available
  • <3,N;N-Oxidation;R1>
  • <11,12;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <13,H;Hydroxylation;R2>
  • <13,12;Cleavage;R2>
  • <12,11;Cleavage;R2>
  • <3,N;N-Oxidation;R3>
  • (show allshow less)
  • <11,12;Cleavage;R1>
  • <11,H;Oxidation;R1>
  • <3,N;N-Oxidation;R2>
CC02470NNALOgrxkbuczffstl jtqlqieisa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <4,N;N-Oxidation;R1>
  • <9,3;Cleavage;R2>
  • <8,1;Oxidation;R3>
CC02090NMPhAMaxcwsijkvasqc uhfffaoysa n
  • Not Available
  • <5,3;Cleavage;R1>
  • <5,H;Hydroxylation;R1>
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
CC02089NMEARtdcjkarqcronf uhfffaoysa n
  • Not Available
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
  • <4,3;Cleavage;R1>
  • <4,H;Oxidation;R1>
  • <5,3;Cleavage;R2>
  • <5,H;Oxidation;R2>
CC01863NMBAPktscjxwlvrekx uhfffaoysa n
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
  • <5,H;Oxidation;R1>
  • <5,3;Cleavage;R1>
  • <4,H;Oxidation;R2>
  • <4,3;Cleavage;R2>
CC02424NitrendipinePvhujelljljgln mrxnpfedsa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <10,H;Oxidation;R1>
  • <10,11;Oxidation;R1>
  • <11,12;Reduction;R1>
  • <12,7;Oxidation;R1>
  • <7,8;Oxidation;R1>
  • <8,9;Reduction;R1>
  • <9,10;Oxidation;R1>
  • <7,H;Oxidation;R1>
  • (show allshow less)
CC02423NifedipineHyimsnhjobljnt uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <10,H;Oxidation;R1>
  • <10,11;Oxidation;R1>
  • <11,12;Reduction;R1>
  • <12,7;Oxidation;R1>
  • <7,8;Oxidation;R1>
  • <8,9;Reduction;R1>
  • <9,10;Oxidation;R1>
  • <7,H;Oxidation;R1>
  • (show allshow less)
CC01997NicotineSnicxcgakadscv jtqlqieisa n
  • <10,H;Oxidation;R1>
  • <9,8;Cleavage;R1>
  • <9,H;Oxidation;R1>
  • <10,H;Oxidation;R2>
  • <4,H;Hydroxylation;R3>
  • <9,8;Cleavage;R1>
  • <9,H;Oxidation;R1>
  • <10,H;Oxidation;R2>
  • <10,H;Oxidation;R2>
  • <10,H;Oxidation;R2>
  • <10,H;Oxidation;R2>
  • <9,8;Cleavage;R1>
  • <9,H;Oxidation;R1>
  • <10,H;Oxidation;R2>
  • <10,H;Oxidation;R2>
  • <9,8;Cleavage;R1>
  • <9,H;Oxidation;R1>
  • <10,H;Oxidation;R2>
CC01996NicardipineZbbhbtpttswhba xmmpixpasa n
  • Not Available
  • Not Available
  • Not Available
  • <28,27;Cleavage;R1>
  • <28,H;Oxidation;R1>
  • <13,H;Oxidation;R2>
  • <13,9;Rearrangement;R2>
  • <9,4;Rearrangement;R2>
  • <4,1;Rearrangement;R2>
  • <1,3;Rearrangement;R2>
  • <3,7;Rearrangement;R2>
  • <7,13;Rearrangement;R2>
  • <1,H;Oxidation;R2>
  • (show allshow less)
  • Not Available
  • Not Available
  • <28,27;Cleavage;R1>
  • <28,H;Oxidation;R1>
  • Not Available
  • <28,27;Cleavage;R1>
  • <28,H;Oxidation;R1>
  • <13,H;Oxidation;R2>
  • <13,9;Rearrangement;R2>
  • <9,4;Rearrangement;R2>
  • <4,1;Rearrangement;R2>
  • <1,3;Rearrangement;R2>
  • <3,7;Rearrangement;R2>
  • <7,13;Rearrangement;R2>
  • <1,H;Oxidation;R2>
  • (show allshow less)
CC02144NevirapineNqdjxkovjztuja uhfffaoysa n
  • Not Available
  • Not Available
  • <5,H;Hydroxylation;R1>
  • <15,H;Hydroxylation;R2>
  • Not Available
  • <19,H;Hydroxylation;R1>
  • Not Available
  • <5,H;Hydroxylation;R1>
  • <19,H;Hdroxylation;R2>
  • Not Available
  • <5,H;Hydroxylation;R1>
  • <14,H;Hydroxylation;R2>
  • <19,H;Hydroxylaton;R3>
CC02188NelfinavirQagykunxzhxkmr hkwsixnmsa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <24,H;Hydroxylation;R1>
  • <25,H;Hydroxylation;R2>
  • <26,H;Hydroxylation;R3>
  • Not Available
  • Not Available
  • <5,H;UnspReduction;R1>
  • <39,H;Hydroxylation;R2>
CC02422NefazodoneVrbkivrkkclpha uhfffaoysa n
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • Not Available
  • <30,H;Hydroxylation;R1>
  • <16,H;Hydroxylation;R2>
  • <20,21;Cleavage;R3>
  • <20,H;Oxidation;R3>
CC01995NE-100Ybliqjgxrlzbcz uhfffaoysa n
  • <15,6;Cleavage;R1>
  • <15,H;Oxidation;R1>
  • <16,6;Cleavage;R2>
  • <16,H;Oxidation;R2>
  • Not Available
  • Not Available
  • Not Available
  • <15,6;Cleavage;R1>
  • <15,H;Oxidation;R1>
  • <16,6;Cleavage;R2>
  • <16,H;Oxidation;R2>
  • <17,11;Cleavage;R3>
  • <17,H;Oxidation;R3>
  • (show allshow less)
  • <15,6;Cleavage;R1>
  • <15,H;Oxidation;R1>
  • <16,6;Cleavage;R2>
  • <16,H;Oxidation;R2>
  • <17,11;Cleavage;R3>
  • <17,H;Oxidation;R3>
  • (show allshow less)
  • <15,6;Cleavage;R1>
  • <15,H;Oxidation;R1>
  • <16,6;Cleavage;R2>
  • <16,H;Oxidation;R2>
  • <17,11;Cleavage;R3>
  • <17,H;Oxidation;R3>
  • <24,H;Hydroxylation;R4>
  • <25,H;Hydroxylation;R5>
  • <26,H;Hydroxylation;R6>
  • (show allshow less)
  • Not Available
  • <15,6;Cleavage;R1>
  • <15,H;Oxidation;R1>
  • <16,6;Cleavage;R2>
  • <16,H;Oxidation;R2>
  • <24,H;Hydroxylation;R3>
  • <25,H;Hydroxylation;R4>
  • <26,H;Hydroxylation;R5>
  • (show allshow less)
Displaying compounds 201 - 225 of 679 in total