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


and

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





INPUT WORD = C00001208 , 50% or more
[ Metabolite Name : Valeric acid , pentanoic acid ]
Number of matched data : 57

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00001189 3-Methylbutyric acid
Isovaleric acid
3-Methylbutanoic acid
92.31
C00001194 3-(Methylthio)propionic acid 92.31
C00001337 GABA
Gamma-aminobutyric acid
4-Aminobutyric acid
gamma-Aminobutyric acid
92.31
C00019682 Succinaldehydic acid
beta-Formylpropionic acid
4-Oxobutanoic acid
92.31
C00029461 2-Methylbutyric acid
2-Methylbutanoic acid
92.31
C00033067 Isovalerate 92.31
C00035617 Ethyl propionate
Ethyl propanoate
92.31
C00035729 Propyl acetate 92.31
C00036488 2-Hexanol 92.31
C00001218 Caproic acid
1-Hexanoic acid
Hexanoic acid
n-Hexanoic acid
86.67
C00001343 acetidine 2-carboxylic acid
Azetidine-2-carboxylic acid
(2S)-2-Azetidinecarboxylic acid
L-Azetidine 2-carboxylic acid
85.71
C00018800 Azirinomycin 85.71
C00040580 Tulipalin A 85.71
C00000351 (2E)-2-Hexanal
trans-2-Hexenal
(2E)-Hexenal
84.62
C00000354 trans-2-Hexenol 84.62
C00000355 trans-3-Hexenol
(E)-3-Hexen-1-ol
(E)-3-Hexenol
trans-3-Hexen-1-ol
84.62
C00000357 Hexanal
n-Hexanal
Hexenal
84.62
C00000358 Hexan-1-ol
1-Hexanol
Hexanol
n-Hexanol
84.62
C00001180 Butanoic acid
Butyric acid
84.62
C00001207 Tiglic acid 84.62
C00007458 Acetoacetic 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
C00029460 2-Methyl-2-butenoic acid 84.62
C00032372 trans-3-Methylthioacrylamide 84.62
C00033555 2-Methyl-1,3-butanediol 84.62
C00035479 2-Hexen-1-ol 84.62
C00035480 (2E)-Hex-2-enal
2-Hexenal
(E)-Hex-2-enal
84.62
C00035484 2-methylhexane 84.62
C00035493 3-Methyl-2-pentanol 84.62
C00035784 1-Pentanol
n-Pentanol
84.62
C00035792 3-Methyl-1-pentanol
3-Methylbutanol
84.62
C00036546 3-Hexen-1-ol 84.62
C00036556 3-Methyl-butanamide 84.62
C00043175 2-Methylbutyramide 84.62
C00048948 3-Hexenal 84.62
C00048963 (Z)-2-hexen-1-ol
cis-2-Hexen-1-ol
84.62
C00001388 L-Proline
L-Pro
81.25
C00000747 L-S-methylcysteine
S-Methyl cysteine
80.00
C00001183 Fumaric acid 80.00
C00001205 Succinic acid 80.00
C00001254 Heptan-2-one
Methyl-n-pentyl ketone
2-Heptanone
80.00
C00001353 L-alpha,gamma-Diaminobutyric acid 80.00
C00001365 L-Homocysteine 80.00
C00001366 L-Homoserine 80.00
C00001380 3-Methylamino-L-alanine 80.00
C00001382 Se-methyl-L-selenocysteine 80.00
C00001398 L-Valine
L-Val
80.00
C00007469 L-Aspartate 4-semialdehyde 80.00
C00007623 Ketovaline
2-Ketoisovalerate
alpha-Ketoisovalerate
3-Methyl-2-oxobutanoic acid
80.00
C00033849 Fumarate 80.00
C00034232 Se-Methylselenocysteine 80.00
C00034868 L-2,4-Diaminobutyric acid
DABA
(-)-L-2,4-Diaminobutyric acid
80.00
C00044037 (2R,3R)-Nilic acid 80.00
C00045681 beta-Methylaminoalanine 80.00
C00048247 (S)-2-Heptanol 80.00
C00048958 Butyl acetate 80.00
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