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


and

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




INPUT WORD = C00010807 , 50% or more
[ Metabolite Name : 2-Isopropylcyclopentanone ]
Number of matched data : 59

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010859 Isopropylcyclohexane 88.89
C00041442 cis-2-Hydroxymethyl-3-methylcyclopentanone 88.89
C00007414 2-Ethylhexanoic acid 84.21
C00000334 Cyclohexylcarboxylic acid
Hexahydrobenzoic acid		 83.33
C00001264 1-Octanol
Octan-1-ol
Octanol
n-Octanol		 83.33
C00010808 Campholene
1,2,3,3-Tetramethylcyclopentene		 83.33
C00011400 6-Methyl-5-hepten-2-one 83.33
C00018286 Scorodonin 83.33
C00029316 (2E)-Octenal
trans-Oct-2-en-1-al
(E)-2-Octenal
trans-2-Octenal		 83.33
C00029423 1-Octen-3-ol
Oct-1-en-3-ol		 83.33
C00030880 Octanal
n-Octanal		 83.33
C00034755 trans-2-Heptenal
(E)-2-Heptenal
trans-2-Heptanal		 83.33
C00035495 3-Octanol
Octan-3-ol		 83.33
C00042095 2-Cyclohexylethylamine 83.33
C00046415 Squamolone 83.33
C00047097 CID is old! 83.33
C00036497 2-Isopropenyl-5-methylhexa-trans-3,5-diene-1-ol 80.95
C00002074 Stachydrine 80.00
C00010471 Adoxosidic acid 80.00
C00010975 (R)-o-Mentha-1(7),5,8-triene 80.00
C00030540 alpha-Isophorone
Isophorone		 80.00
C00001317 (E,Z)-2,6-Nonadienal
Nona-2,6-dienal
(2E,6Z)-Nona-2,6-dienal		 78.95
C00010304 (E)-(R)-(-)-2,6-Dimethyl-1,4,7-octatriene 78.95
C00010352 2,5-Dimethyl-3-vinyl-1,4-hexadiene 78.95
C00029331 (2E)-2-Nonenal
(E)-Non-2-enal
(E)-2-Nonenal
(2E)-Non-2-enal
trans-2-Nonenal
trans-2-Nonen-1-al		 78.95
C00029463 2-Nonanone
Nonan-2-one		 78.95
C00030828 Nonadienal
Nonanal
n-Nonanal		 78.95
C00030830 Nonanol
n-Nonanol
1-Nonanol		 78.95
C00033589 7-Octene-1,6-diol 78.95
C00034676 Santolina triene 78.95
C00034756 (E,E)-2,4-Nonadienal 78.95
C00035503 4-Nonanol 78.95
C00035504 4-Nonanone 78.95
C00048310 2,6-Dimethyl-2,4,6-octatriene
Allo-Ocimene
Alloocimene		 78.95
C00048315 alpha-Myrcene 78.95
C00048486 Neo-allo-ocimene
Neoalloocimene		 78.95
C00049076 2-Acetonyl-3,5-dihydroxy-7-methoxy-1,4-naphthoquinone 78.95
C00000336 1-Cyclohexenylcarboxylic acid 77.78
C00000395 1,5Z-Octadien-3R-ol 77.78
C00000397 1,5Z-Octadien-3S-ol 77.78
C00002030 gamma-Coniceine 77.78
C00002031 Coniine
(+)-Coniine		 77.78
C00007610 4-Metyl-5-(beta-hydroxyethyl)thiazole
4-methyl-5-(2hydroxyethyl)thiazole		 77.78
C00017553 (-)-(1R,2S)-Cispentacin
(-)-Cispentacin
Antibiotic FR 109615
Cispentacin
FR 109615
cis-(1R,2S)-2-Aminocyclopentane-1-carboxylic acid		 77.78
C00017992 Methylenomycin B 77.78
C00028721 Norhygrine
N-Demethylhygrine		 77.78
C00029580 6-Methyl-5-hepten-2-ol
Sulcatol		 77.78
C00030220 Ethyl-2-methylbutanoate
Ethyl 2-methyl butyrate
ethyl 2-methyl butyrate
Ethyl 2-methylbutanoate		 77.78
C00034765 3-Octanone
Octan-3-one		 77.78
C00034775 6-Methyl-5-hepten-2-one
6-Methylhept-5-en-2-one		 77.78
C00034880 Heptanal
n-Heptanal		 77.78
C00034881 N-Methylproline
N-Methyl-L-proline
(-)-N-Methyl-L-proline		 77.78
C00035116 3-Methyl butyl acetate
Isoamyl acetate
3-Methylbutyl acetate		 77.78
C00035500 4-Heptanol 77.78
C00035501 4-Heptanone 77.78
C00035700 n-Heptanol 77.78
C00035797 6-Methyl-1-heptene 77.78
C00036613 6-Deoxy-fagomine
(-)-6-Deoxy-fagomine		 77.78
C00047172 Ampelomin A
(+)-Ampelomin A		 77.78
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