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


and

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




INPUT WORD = C00043490 , 50% or more
[ Metabolite Name : epi-Isoshinanolone , (+)-epi-Isoshinanolone ]
Number of matched data : 62

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00025312 Isoshinanolone
(+)-cis-Isoshinanolone
cis-Isoshinanolone		 100.00
C00000119 4-Hydroxymellein 93.10
C00029969 cis-4-Hydroxymellein
cis-3S,4S-4-Hydroxymellein		 93.10
C00031466 (4S)-4,8-Dihydroxy-alpha-tetralone 93.10
C00032373 trans-4-Hydroxymellein 93.10
C00036621 6-Hydroxy-2,2-dimethylchroman-4-one 93.10
C00015407 F 11334A2 89.66
C00029429 2-(2-Hydroxyethyl)-4-hydroxyisoindolin-1-one 89.66
C00030545 Isosafrol glycol 89.66
C00031463 (4R)-4,8-Dihydroxy-alpha-tetralone 89.66
C00035707 N-Salicyloyl-2-aminopropan-1-ol 89.66
C00040942 Dictafolin A
(+)-Dictafolin A		 89.66
C00032616 2,3-Epoxyplumbagin 87.50
C00050393 Plumbagic acid
(+)-Plumbagic acid		 87.50
C00016193 Acetophthalidin 87.10
C00034397 5,8-Dihydroxy-4-methoxy-1-tetralone 87.10
C00050394 Plumbolactone A 87.10
C00035706 N-Salicyloyl-2-aminopropan-1,3-diol 86.67
C00000550 (R)-(-)-Mellein
Mellein
Ochracin		 86.21
C00000554 6-Hydroxymellein
6HM		 86.21
C00002852 Plumbagin
Plumbagine		 86.21
C00015409 (E)-2-(3-hydroxy-3-methyl-1-butenyl)-1,4-benzenediol
F 11334B1		 86.21
C00022591 3,4-Dimethoxypropiophenone 86.21
C00029477 3,4'-Dihydroxy-3'-methoxypropiophenone
3-Hydroxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone
beta-Hydroxypropiovanillone
beta-Hydroxypropiovanillone
omega-Hydroxypropioguaiacone		 86.21
C00034393 4-(2-Hydroxyphenyl)-4-oxobutyric acid 86.21
C00035948 4-Ethoxy-3-methoxybenzoic acid 86.21
C00042155 5-Methylmellein 86.21
C00043793 Oospolactone 86.21
C00045560 3-Deoxyisoochracinic acid
(-)-3-Deoxyisoochracinic acid		 86.21
C00040817 3-Ethoxy-1-(4-hydroxy-3-methoxyphenyl)-1-propanone 84.38
C00002433 Lathodoratin 83.87
C00001282 Eutypine 83.33
C00007604 L-Kynurenine 83.33
C00015215 Sterin B 83.33
C00015406 F 11334A1 83.33
C00033511 1-(3,4-Dimethoxyphenyl)-1,3-propanediol 83.33
C00035911 Benzyl hexanoate 83.33
C00043513 Frustulosinol 83.33
C00047149 4-(4'-Hydroxy-3'-methylbutoxy)benzaldehyde 83.33
C00047666 4-(3-Methoxy-4-hydroxy)phenyl-3-methyl-3-buten-2-one 83.33
C00049129 Capillaridin E 83.33
C00049489 Morinin G
(-)-Morinin G		 83.33
C00000551 6,8-Dihydroxy-3-methylisocoumarin 82.76
C00000553 5-Hydroxy-2-methylchromone 82.76
C00002439 Precocene 1 82.76
C00002859 7-Methyljuglone
Ramentaceone		 82.76
C00003020 2,4,8-Trihydroxy-1-tetralone 82.76
C00010841 Desacetylcalaminthone 82.76
C00015408 F 11334A3 82.76
C00018324 Siccayne 82.76
C00019469 4-(1,1-Dimethyl-2-propenyl)-1,3-benzenediol 82.76
C00026238 (-)-Chrysogine 82.76
C00026242 Glomerin
,2-Dimethyl-4(1H)-quinazolone
1,2-Dimethyl-4-oxoquinazoline		 82.76
C00030483 Hippuric acid 82.76
C00033193 Methyl isovanillate 82.76
C00033677 Bullatenone 82.76
C00036496 2-Hydroxyjuglone 82.76
C00037118 erythro-Anethole glycol 82.76
C00037523 Multiflorol
Thymyloxyethanol		 82.76
C00039440 Isoferulaldehyde 82.76
C00041687 N-Butylbenzenesulfonamide 82.76
C00043506 Fomannoxin 82.76
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