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


and

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




INPUT WORD = C00035729 , 50% or more
[ Metabolite Name : Propyl acetate ]
Number of matched data : 67

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00001189 3-Methylbutyric acid
Isovaleric acid
3-Methylbutanoic acid		 92.31
C00001208 Valeric acid
pentanoic acid		 92.31
C00010280 3-Methyl-2-butenoic acid 92.31
C00033067 Isovalerate 92.31
C00033555 2-Methyl-1,3-butanediol 92.31
C00035617 Ethyl propionate
Ethyl propanoate		 92.31
C00036488 2-Hexanol 92.31
C00048958 Butyl acetate 86.67
C00029343 (R)-3,4-Dihydroxybutanoic acid gamma-lactone
(+)-(R)-3-Hydroxy-.gamma.-butyrolactone		 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
C00001194 3-(Methylthio)propionic acid 84.62
C00001207 Tiglic acid 84.62
C00001308 Ethyl acetate 84.62
C00001337 GABA
Gamma-aminobutyric acid
4-Aminobutyric acid
gamma-Aminobutyric acid		 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
C00029460 2-Methyl-2-butenoic acid 84.62
C00029461 2-Methylbutyric acid
2-Methylbutanoic acid		 84.62
C00032371 trans-3-Methylsulfinyl-2-propenol
(+)-trans-3-Methylsulfinyl-2-propenol		 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
C00035792 3-Methyl-1-pentanol
3-Methylbutanol		 84.62
C00036428 1-Deoxythreitol 84.62
C00048948 3-Hexenal 84.62
C00000303 Parasorbic acid 81.25
C00001218 Caproic acid
1-Hexanoic acid
Hexanoic acid
n-Hexanoic acid		 80.00
C00001254 Heptan-2-one
Methyl-n-pentyl ketone
2-Heptanone		 80.00
C00001398 L-Valine
L-Val		 80.00
C00007623 Ketovaline
2-Ketoisovalerate
alpha-Ketoisovalerate
3-Methyl-2-oxobutanoic acid		 80.00
C00044037 (2R,3R)-Nilic acid 80.00
C00048247 (S)-2-Heptanol 80.00
C00001343 acetidine 2-carboxylic acid
Azetidine-2-carboxylic acid
(2S)-2-Azetidinecarboxylic acid
L-Azetidine 2-carboxylic acid		 78.57
C00029568 5-Hydroxypyrrolidin-2-one 78.57
C00035853 Cyclohexylmethane
Methylcyclohexane		 78.57
C00039855 N-Methyl-2-pyrrolidone 78.57
C00044142 Cyclohexylamine 78.57
C00000352 (E)-3-Hexenal 76.92
C00000353 (Z)-3-Hexenal
cis-3-Hexenal		 76.92
C00000356 cis-3-Hexen-1-ol
(Z)-3-hexen-1-ol
(3Z)-3-Hexen-1-ol		 76.92
C00001180 Butanoic acid
Butyric acid		 76.92
C00001185 D-Glyceric acid
Glyceric acid		 76.92
C00001193 Malonic acid 76.92
C00001244 Diallyl sulfide 76.92
C00001297 Triacetylene 76.92
C00001393 L-Serine
L-Ser		 76.92
C00001403 Cadaverine 76.92
C00001413 Hexylamine 76.92
C00007458 Acetoacetic acid 76.92
C00007464 3-Mercaptopyruvic acid 76.92
C00015490 Penitricin D 76.92
C00018267 (S)-2-Amino-3-butynoic acid
(S)-Ethynylglycine
Antibiotic FR 900130
FR 900130		 76.92
C00029462 Isobutyric acid
2-Methylpropanoic acid		 76.92
C00032372 trans-3-Methylthioacrylamide 76.92
C00035784 1-Pentanol
n-Pentanol		 76.92
C00035785 pent-1-en-3-one
1-Penten-3-one		 76.92
C00036546 3-Hexen-1-ol 76.92
C00036556 3-Methyl-butanamide 76.92
C00043175 2-Methylbutyramide 76.92
C00048949 Isovaleraldehyde
3-Methyl-butanal
3-Methylbutanal
3-methylbutanal		 76.92
C00049006 n-Hexane 76.92
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