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


and

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




INPUT WORD = C00048943 , 50% or more
[ Metabolite Name : 3,4-Dimethyl heptane ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00010859 Isopropylcyclohexane 88.89
C00000395 1,5Z-Octadien-3R-ol 88.24
C00000397 1,5Z-Octadien-3S-ol 88.24
C00001264 1-Octanol
Octan-1-ol
Octanol
n-Octanol		 88.24
C00030220 Ethyl-2-methylbutanoate
Ethyl 2-methyl butyrate
ethyl 2-methyl butyrate
Ethyl 2-methylbutanoate		 88.24
C00034765 3-Octanone
Octan-3-one		 88.24
C00010303 2,6-Dimethyl-1,3,5,7-octatetraenene
(E,E)-Cosmene
Cosmene		 84.21
C00010304 (E)-(R)-(-)-2,6-Dimethyl-1,4,7-octatriene 84.21
C00010306 (E)-3,7-Dimethyl-1,3,7-octatriene 84.21
C00010307 (Z)-3,7-Dimethyl-1,3,7-octatriene 84.21
C00037789 Santene 84.21
C00048263 2,6-Dimethyl-1,3,5,7-octatetraene 84.21
C00048315 alpha-Myrcene 84.21
C00048375 Decane 84.21
C00002030 gamma-Coniceine 83.33
C00002031 Coniine
(+)-Coniine		 83.33
C00010808 Campholene
1,2,3,3-Tetramethylcyclopentene		 83.33
C00001310 Ethyl 2-methylbut-2-enoate
Ethyl tiglate		 82.35
C00029423 1-Octen-3-ol
Oct-1-en-3-ol		 82.35
C00034761 2E,4Z-Octadienal 82.35
C00034882 Nonane
n-Nonane		 82.35
C00035483 2-Methyl butyl acetate
2-Methylbutyl acetate		 82.35
C00035495 3-Octanol
Octan-3-ol		 82.35
C00035500 4-Heptanol 82.35
C00035501 4-Heptanone 82.35
C00035797 6-Methyl-1-heptene 82.35
C00035928 3,5-Nonadiyne 82.35
C00000806 (-)-beta-Pinene
(-)-Nopinene		 80.95
C00000816 beta-Pinene
(+)-beta-Pinene
beta-Pirene		 80.95
C00000818 (+)-Camphene 80.95
C00000857 d-Sabinene
(+)-Sabinene		 80.95
C00003029 Camphene 80.95
C00011053 (-)-Sabinene
(-)-4(10)-Thujene		 80.95
C00011055 (2-exo,3-endo)-2,3-dimethyl-Bicyclo[2.2.1]heptan-2-ol 80.95
C00031258 4(10)-Thujene
Sabinene
Sabinen		 80.95
C00040901 Bornane 80.95
C00002047 (-)-Hygroline
Hygroline		 80.00
C00002055 N-Methylconiine
(+)-N-methylconiine		 80.00
C00007414 2-Ethylhexanoic acid 78.95
C00010305 (Z)-(R)-(+)-2,6-Dimethyl-1,4,7-octatriene 78.95
C00010352 2,5-Dimethyl-3-vinyl-1,4-hexadiene 78.95
C00035117 2-Methylpropyl 2-methylpropanoate
Isobutyl isobutyrate
isobutyl isobutanoate		 78.95
C00035546 Butyl butyrate 78.95
C00035612 Ethyl hexanoate
Ethyl caproate		 78.95
C00036768 Artemisia triene 78.95
C00049076 2-Acetonyl-3,5-dihydroxy-7-methoxy-1,4-naphthoquinone 78.95
C00000334 Cyclohexylcarboxylic acid
Hexahydrobenzoic acid		 77.78
C00036613 6-Deoxy-fagomine
(-)-6-Deoxy-fagomine		 77.78
C00042095 2-Cyclohexylethylamine 77.78
C00042802 Ophiocerin A
(-)-Ophiocerin A		 77.78
C00042803 Ophiocerin B
(-)-Ophiocerin B		 77.78
C00042804 Ophiocerin C
(+)-Ophiocerin C		 77.78
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