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


and

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





INPUT WORD = C00048964 , 50% or more
[ Metabolite Name : cis-3-Hexenyl acetate , (Z)-3-Hexenyl acetate ]
Number of matched data : 66

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00035701 1-Hexyl acetate
n-Hexyl acetate
Hexyl acetate
94.74
C00035766 (E)-2-Hexenyl acetate
trans-2-Hexenyl acetate
94.74
C00001231 Octanoic acid
Caprylic acid
n-Octanoic acid
89.47
C00029463 2-Nonanone
Nonan-2-one
89.47
C00035117 2-Methylpropyl 2-methylpropanoate
Isobutyl isobutyrate
isobutyl isobutanoate
89.47
C00035546 Butyl butyrate 89.47
C00035612 Ethyl hexanoate
Ethyl caproate
89.47
C00000395 1,5Z-Octadien-3R-ol 84.21
C00000397 1,5Z-Octadien-3S-ol 84.21
C00000772 7-Mercaptoheptanoic acid
7-Thioheptanoic acid
84.21
C00001317 (E,Z)-2,6-Nonadienal
Nona-2,6-dienal
(2E,6Z)-Nona-2,6-dienal
84.21
C00007414 2-Ethylhexanoic acid 84.21
C00033589 7-Octene-1,6-diol 84.21
C00035116 3-Methyl butyl acetate
Isoamyl acetate
3-Methylbutyl acetate
84.21
C00035503 4-Nonanol 84.21
C00035504 4-Nonanone 84.21
C00001312 (Z)-3,5-Hexadienyl butyrate 82.61
C00001318 gamma-Nonalactone
gamma-Nonanolactone
gamma-muurolol
81.82
C00034495 E-beta-Ocimene epoxide
Myroxide
81.82
C00043313 Biformin 81.82
C00000447 4-Hydroxy-2E-nonenal 80.95
C00010289 (+)-1,5-Dimethyl-6,8-dioxabicyclo[3.2.1]octane
(R)-(+)-Frontalin
80.95
C00029453 2-Decanol
2-Hydroxydecane
80.95
C00030829 Nonanoic acid
Pelargonic acid
n-Nonanoic acid
80.95
C00034760 2-Decanone 80.95
C00002047 (-)-Hygroline 80.00
C00002062 Pelletierine
(-)-Pelletierine
80.00
C00002064 Pinidine 80.00
C00002068 Pseudoconhydrine 80.00
C00010975 (R)-o-Mentha-1(7),5,8-triene 80.00
C00015995 Trichodenone C 80.00
C00015997 (R)-4-Ethenyltetrahydro-4-hydroxy-2H-pyran-2-one
(-)-Harzialactone B
Harzialactone B
80.00
C00046982 (+)-Allosedridine 80.00
C00023986 Jasmine lactone
cis-7-Decen-5-olide
79.17
C00000334 Cyclohexylcarboxylic acid
Hexahydrobenzoic acid
78.95
C00000336 1-Cyclohexenylcarboxylic acid 78.95
C00001264 1-Octanol
Octan-1-ol
Octanol
n-Octanol
78.95
C00002043 Guvacine 78.95
C00007420 alpha-Ketopantoate 78.95
C00007459 O-Acetyl-L-serine
O-Acetylserine
78.95
C00007476 5-(Methylthio)-2-oxo-pentanoic acid 78.95
C00010303 2,6-Dimethyl-1,3,5,7-octatetraenene
(E,E)-Cosmene
Cosmene
78.95
C00010304 (E)-(R)-(-)-2,6-Dimethyl-1,4,7-octatriene 78.95
C00010306 (E)-3,7-Dimethyl-1,3,7-octatriene 78.95
C00010307 (Z)-3,7-Dimethyl-1,3,7-octatriene 78.95
C00010352 2,5-Dimethyl-3-vinyl-1,4-hexadiene 78.95
C00011400 6-Methyl-5-hepten-2-one 78.95
C00018286 Scorodonin 78.95
C00029316 (2E)-Octenal
trans-Oct-2-en-1-al
(E)-2-Octenal
trans-2-Octenal
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
C00029423 1-Octen-3-ol
Oct-1-en-3-ol
78.95
C00029580 6-Methyl-5-hepten-2-ol
Sulcatol
78.95
C00030220 Ethyl-2-methylbutanoate
Ethyl 2-methyl butyrate
ethyl 2-methyl butyrate
Ethyl 2-methylbutanoate
78.95
C00030828 Nonadienal
Nonanal
n-Nonanal
78.95
C00030830 Nonanol
n-Nonanol
1-Nonanol
78.95
C00030880 Octanal
n-Octanal
78.95
C00034756 (E,E)-2,4-Nonadienal 78.95
C00034765 3-Octanone
Octan-3-one
78.95
C00034775 6-Methyl-5-hepten-2-one
6-Methylhept-5-en-2-one
78.95
C00034882 Nonane
n-Nonane
78.95
C00035483 2-Methyl butyl acetate
2-Methylbutyl acetate
78.95
C00035495 3-Octanol 78.95
C00035928 3,5-Nonadiyne 78.95
C00048033 Osmundalactone
(-)-Osmundalactone
78.95
C00048263 2,6-Dimethyl-1,3,5,7-octatetraene 78.95
C00048315 alpha-Myrcene 78.95
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