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


and

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





INPUT WORD = C00035702 , 50% or more
[ Metabolite Name : Hexyl butanoate , Hexyl butyrate , n-Hexyl butyrate ]
Number of matched data : 50

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00035767 trans-2-Hexenyl butyrate 95.65
C00001213 Capric acid
Decanoic acid
n-Decanoic acid
91.30
C00001312 (Z)-3,5-Hexadienyl butyrate 91.30
C00035506 4-Undecanol 91.30
C00035507 4-Undecanone 91.30
C00035509 5-Pentyl-3H-furan-2-one
5-(1-Pentyl)-3H-furan-2-one
91.30
C00035557 Caprylyl acetate
1-Octyl acetate
91.30
C00035613 Ethyl octanoate
Ethyl caprylate
91.30
C00049004 Methyl nonanoate 91.30
C00001287 Lachnophyllum ester 88.00
C00010949 (-)-Mintlactone 88.00
C00010950 (+)-Isomintlactone 88.00
C00030481 Hexyl 3-methyl butyrate
Hexyl isovalerate
88.00
C00035642 Hexyl 2-methylbutanoate 88.00
C00000838 3,4-Menthone lactone 87.50
C00010370 Santolinolide B 87.50
C00023985 delta-Decalactone
5-Decanolide
87.50
C00023986 Jasmine lactone
cis-7-Decen-5-olide
87.50
C00000244 Hormodirene
trans-1-(1E,3Z-Hexadienyl)-2-vinylcyclopropane
86.96
C00001248 Dodecane 86.96
C00001318 gamma-Nonalactone
gamma-Nonanolactone
gamma-muurolol
86.96
C00010311 (S)-3,7-Dimethyl-6-octenoic acid
(S)-Citronellic acid
86.96
C00010363 (E)-Lyratic acid
4-Ethenyl-2,5-dimethyl-2,5-hexadienoic acid
86.96
C00010366 5-Methyl-2-methylene-4-vinyl-5-hexene-1,3-diol 86.96
C00010615 Mitsugashiwalactone 86.96
C00010616 Onikulactone 86.96
C00029332 (E)-2-Undecenal
trans-2-Undecenal
86.96
C00030758 2-Undecanone
Undecan-2-one
Methyl nonyl ketone
86.96
C00049081 3,7-Dimethyl-5-hydroxyoct-1-en-6-one
(+)-3,7-Dimethyl-5-hydroxyoct-1-en-6-one
86.96
C00023988 3,5-Dihydroxydecanoic acid delta-lactone 84.62
C00000396 10-Oxo-8E-decenoic acid 84.00
C00000841 6-Oxocamphor 84.00
C00003058 (+)-Rotundifolone 84.00
C00003090 (+)-Neomatatabiol 84.00
C00010369 Santolinic acid methyl ester 84.00
C00010541 Dihydronepetalactone 84.00
C00010542 Dolicholactone 84.00
C00010617 Boonein 84.00
C00010636 Neonepetalactone 84.00
C00010830 Piperitone oxide
1,2-Epoxy-p-menthan-3-one
84.00
C00011018 2,10-Bornanediol 84.00
C00017114 (+)-Streptenol A
IC 201
Streptenol A
84.00
C00017115 Streptenol B 84.00
C00017116 Streptenol C 84.00
C00017117 Streptenol D 84.00
C00022621 (E,Z)-Marticaria ester 84.00
C00029347 (Z)-3-Hexenyl 3-methylbutanoate
(Z)-3-Hexenyl isovalerate
84.00
C00030482 Hexyl tiglate 84.00
C00035369 Piperitenone oxide 84.00
C00035690 Methyl caprate
Methyl decanoate
84.00
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