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


and

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





INPUT WORD = C00001207 , 50% or more
[ Metabolite Name : Tiglic acid ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029460 2-Methyl-2-butenoic acid 100.00
C00029461 2-Methylbutanoic acid
2-Methylbutyric acid
92.31
C00035617 Ethyl propanoate
Ethyl propionate
92.31
C00040580 Tulipalin A 85.71
C00001194 3-(Methylthio)propionic acid 84.62
C00001208 pentanoic acid
Valeric acid
84.62
C00001337 GABA
Gamma-aminobutyric acid
4-Aminobutyric acid
gamma-Aminobutyric acid
84.62
C00007563 Hydroxypyruvic acid 84.62
C00010280 3-Methyl-2-butenoic acid 84.62
C00018267 (S)-2-Amino-3-butynoic acid
(S)-Ethynylglycine
Antibiotic FR 900130
FR 900130
84.62
C00019675 2-Ketobutyric acid
2-Oxobutyric acid
2-Oxobutanoic acid
alpha-Ketobutyric acid
84.62
C00019682 Succinaldehydic acid
beta-Formylpropionic acid
4-Oxobutanoic acid
84.62
C00033555 2-Methyl-1,3-butanediol 84.62
C00035493 3-Methyl-2-pentanol 84.62
C00035729 Propyl acetate 84.62
C00036556 3-Methyl-butanamide 84.62
C00043175 2-Methylbutyramide 84.62
C00044037 (2R,3R)-Nilic acid 80.00
C00001343 acetidine 2-carboxylic acid
Azetidine-2-carboxylic acid
(2S)-2-Azetidinecarboxylic acid
L-Azetidine 2-carboxylic acid
78.57
C00007566 1-Aminocyclopropane-1-carboxylate
1-Aminocyclopropane-1-carboxylic acid
78.57
C00018800 Azirinomycin 78.57
C00034296 Succinic anhydride
Tetrahydro-2,5-furandione
78.57
C00000351 (2E)-2-Hexanal
trans-2-Hexenal
(2E)-Hexenal
76.92
C00000354 (E)-2-Hexenol
trans-2-Hexenol
76.92
C00000355 trans-3-Hexenol
(E)-3-Hexen-1-ol
(E)-3-Hexenol
trans-3-Hexen-1-ol
76.92
C00000357 Hexanal
n-Hexanal
Hexenal
76.92
C00000358 Hexan-1-ol
1-Hexanol
Hexanol
n-Hexanol
76.92
C00001180 Butanoic acid
Butyric acid
76.92
C00001185 D-Glyceric acid
Glyceric acid
76.92
C00001189 3-Methylbutanoic acid
3-Methylbutyric acid
Isovaleric acid
76.92
C00001308 Ethyl acetate 76.92
C00001351 L-Cysteine
L-Cys
76.92
C00001393 L-Serine
L-Ser
76.92
C00007323 D-Cysteine 76.92
C00007458 Acetoacetic acid 76.92
C00007464 3-Mercaptopyruvic acid 76.92
C00029462 2-Methylpropanoic acid
Isobutyric acid
76.92
C00033067 Isovalerate 76.92
C00034230 Selenocysteine 76.92
C00035479 2-Hexen-1-ol 76.92
C00035480 (2E)-Hex-2-enal
2-Hexenal
(E)-Hex-2-enal
76.92
C00035484 2-methylhexane 76.92
C00035784 1-Pentanol
n-Pentanol
76.92
C00035785 1-Penten-3-one
pent-1-en-3-one
76.92
C00035792 3-Methyl-1-pentanol
3-Methylbutanol
76.92
C00036428 1-Deoxythreitol 76.92
C00036488 2-Hexanol 76.92
C00048948 3-Hexenal 76.92
C00001310 Ethyl 2-methylbut-2-enoate
Ethyl tiglate
76.47
C00036320 (+)-Tulipalin B 75.00
C00038061 (-)-Tulipalin B 75.00
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