"Twins" retrives similar metabolites in chemical structure.
last update : 2020.01.06
KNApSAcK CID : ex.) C00000001


and

Similarity (%) : ex.) 98
% or more




INPUT WORD = C00019971 , 50% or more
[ Metabolite Name : 7-Methoxy-8-(2-acetoxy-3-methyl-1-oxobut-2-enyl) coumarin ]
Number of matched data : 61

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00019857 Albiflorin 1 97.87
C00019948 6-Methoxy-3',4'-dehydromurranganon 91.49
C00019974 Murrayanone 91.49
C00019987 Omphalocarpin 91.49
C00037141 Ferulagol A 91.49
C00019785 Anisocoumarin E 89.36
C00019788 Anisocoumarin H 89.36
C00019960 (+)-7-(3-Methylbut-2-enyloxy)-8-(2-hydroxy-3-methylbut-3-enyl)coumarin 89.36
C00019964 trans-O-Methylgrandmarin 89.36
C00037062 Diversinin 89.36
C00043481 E-Imperatorin acid 89.36
C00044024 Z-Imperatorin acid 89.36
C00044030 (+)-6-(2-Hydroxy-3-methoxy-3-methylbutyl)-5,7-dimethoxycoumarin 89.36
C00019936 Isomurralonginol isovalerate 88.24
C00019865 (+)-7-(6,7-Epoxy-3,7-dimethyl-5-oxooctanoxy)-coumarin 88.00
C00018753 Lilly 68618
MPA
Melbex
Mycophenolic acid
NSC 129185		 87.23
C00019805 Buntansin C 87.23
C00019881 cis-Grandmarin 87.23
C00019961 (+)-7-(3-Methylbut-2-enyloxy)-8-(4-hydroxy-3-methylbut-2-enyl)coumarin 87.23
C00019966 Murracarpin 87.23
C00033786 Diversin
Diversine		 87.23
C00037872 Swietenocoumarin B 87.23
C00042405 Columbianetin propionate
(+)-Columbianetin propionate		 87.23
C00020001 Peujaponisinol A 86.54
C00019840 (-)-7-(6,7-Dihydroxy-3,7-dimethyl-5-oxooctanoxy)-coumarin 86.27
C00019968 Murralonginol isovalerate 86.27
C00002480 Libanorin 86.00
C00032615 2',3'-Dihydro-jatamansin 86.00
C00032913 Divaricatol 86.00
C00039187 Excavatin C
(+)-Excavatin C		 86.00
C00002142 Bucharaine 85.71
C00019787 Anisocoumarin G 85.71
C00002475 Heliettin 85.42
C00016035 Scytalol C 85.42
C00019786 Anisocoumarin F 85.42
C00032165 Skimmin
(-)-Skimmin		 85.42
C00044128 Cnidiadin 85.42
C00002484 Micromelin 85.11
C00010209 4',5'-Dihydroxy-7-methoxy-5,2'-oxido-4-phenylcoumarin 85.11
C00019945 Merrillin 85.11
C00019953 cis-5-Methoxydecursidinol 85.11
C00019954 trans-5-Methoxydecursidinol 85.11
C00019986 Obtusifolin(coumarin) 85.11
C00029597 8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen
(+)-8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen		 85.11
C00029763 Aurapten
Auraptene		 85.11
C00030905 Oxypeucedanin hydrate
Aviprin
(+)-Aviprin
(+)-Oxypeucedanin hydrate		 85.11
C00030987 Phellopterin 85.11
C00031668 Chaetoquadrin E
(+)-Chaetoquadrin E		 85.11
C00032846 Cnidilin
Knidilin
Isophellopterin		 85.11
C00033230 Murrangatin
(-)-Murrangatin		 85.11
C00035183 Columbianetin acetate 85.11
C00035708 Officinalin isobutyrate 85.11
C00035717 CID is old! 85.11
C00036786 Auraptenol 85.11
C00037142 Ferulagol B 85.11
C00037262 Heraclenol 85.11
C00037581 O-Methylcedrelopsin 85.11
C00039451 Isopurpurasol
(+)-Isopurpurasol		 85.11
C00044035 (+)-Toddanol 85.11
C00044349 Toddanone 85.11
C00044500 Acronyculatin E 85.11
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