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


and

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




INPUT WORD = C00036599 , 50% or more
[ Metabolite Name : 5-Methoxy-8-(1,1-dimethyl-2,3-dihydroxypropyl)-psoralen , (+)-5-Methoxy-8-(1,1-dimethyl-2,3-dihydroxypropyl)-psoralen ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00035023 5-Methoxy-3-(3-methyl-2,3-dihydroxybutyl)psoralen
(-)-5-Methoxy-3-(3-methyl-2,3-dihydroxybutyl)-psoralen		 95.83
C00002453 (+)-Byakangelicin
Byakangelicin		 94.00
C00019974 Murrayanone 91.67
C00019987 Omphalocarpin 91.67
C00029597 8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen
(+)-8-(3-Chloro-2-hydroxy-3-methylbutoxy)psoralen		 91.67
C00030987 Phellopterin 91.67
C00036625 6-Methoxy-5-(3-methyl-2,3-dihydroxybutyl)-angelicin 91.67
C00037165 Furopinnarin 91.67
C00044030 (+)-6-(2-Hydroxy-3-methoxy-3-methylbutyl)-5,7-dimethoxycoumarin 91.67
C00019948 6-Methoxy-3',4'-dehydromurranganon 89.58
C00030531 Isogosferol
Isogospherol
(+)-Isogospherol		 89.58
C00030835 Nordentatin 89.58
C00033066 Isooxypeucedanin 89.58
C00033282 Pabulenol 89.58
C00033364 Saxalin 89.58
C00037261 Heraclenin 89.58
C00043800 Oxyimperatorin 89.58
C00036590 5,8-Dimethoxy-3-(3-methyl-2,3-dihydroxybutyl)-psoralen
(-)-5,8-Dimethoxy-3-(3-methyl-2,3-dihydroxybutyl)-psoralen		 88.46
C00019818 Citrusarin A 87.76
C00019881 cis-Grandmarin 87.50
C00019896 7-(6R-Hydroxy-3,7-dimethylocta-2,5-dienyl)-7-hydroxycoumarin 87.50
C00019953 cis-5-Methoxydecursidinol 87.50
C00019954 trans-5-Methoxydecursidinol 87.50
C00019964 trans-O-Methylgrandmarin 87.50
C00019967 Murraculatin 87.50
C00030475 Herpetolide B 87.50
C00032165 Skimmin
(-)-Skimmin		 87.50
C00037262 Heraclenol 87.50
C00037872 Swietenocoumarin B 87.50
C00044035 (+)-Toddanol 87.50
C00044349 Toddanone 87.50
C00019784 Anisocoumarin D 86.54
C00019865 (+)-7-(6,7-Epoxy-3,7-dimethyl-5-oxooctanoxy)-coumarin 86.00
C00037483 Marmin 85.71
C00002421 Cimifugin 85.42
C00002475 Heliettin 85.42
C00002490 Oxypeucedanin 85.42
C00008558 Aromadendrin 5,7-dimethyl ether 85.42
C00019785 Anisocoumarin E 85.42
C00019960 (+)-7-(3-Methylbut-2-enyloxy)-8-(2-hydroxy-3-methylbut-3-enyl)coumarin 85.42
C00019961 (+)-7-(3-Methylbut-2-enyloxy)-8-(4-hydroxy-3-methylbut-2-enyl)coumarin 85.42
C00019966 Murracarpin 85.42
C00030905 Oxypeucedanin hydrate
Aviprin
(+)-Aviprin
(+)-Oxypeucedanin hydrate		 85.42
C00031473 (S)-(-)-Oxypeucedanin 85.42
C00035717 CID is old! 85.42
C00036120 Greveiglycol 85.42
C00036405 12b-Hydroxy-des-D-garcigerrin A 85.42
C00043481 E-Imperatorin acid 85.42
C00043493 E-Trichoclin
Trichoclin		 85.42
C00044024 Z-Imperatorin acid 85.42
C00044026 Z-Trichoclin 85.42
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