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


and

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




INPUT WORD = C00035784 , 50% or more
[ Metabolite Name : 1-Pentanol , n-Pentanol ]
Number of matched data : 52

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00001297 Triacetylene 90.91
C00019656 4-Aminobutanal
gamma-Aminobutyraldehyde		 90.91
C00035785 1-Penten-3-one
pent-1-en-3-one		 90.91
C00049006 Hexane
n-Hexane		 90.91
C00000351 (2E)-2-Hexanal
trans-2-Hexenal
(2E)-Hexenal		 84.62
C00000354 (E)-2-Hexenol
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
C00001208 pentanoic acid
Valeric acid		 84.62
C00035479 2-Hexen-1-ol 84.62
C00035480 (2E)-Hex-2-enal
2-Hexenal
(E)-Hex-2-enal		 84.62
C00035792 3-Methyl-1-pentanol
3-Methylbutanol		 84.62
C00036488 2-Hexanol 84.62
C00036546 3-Hexen-1-ol 84.62
C00048948 3-Hexenal 84.62
C00001308 Ethyl acetate 81.82
C00001428 1,4-Butanediamine
Putrescine		 81.82
C00007666 3-Hydroxybutyl nitrile 81.82
C00035814 1-Butanol
n-Butanol
Butanol		 81.82
C00043612 Isobutyramide 81.82
C00048949 3-Methyl-butanal
Isovaleraldehyde
3-Methylbutanal
3-methylbutanal		 81.82
C00000352 (E)-3-Hexenal 76.92
C00000353 cis-3-Hexenal
(Z)-3-Hexenal
(Z)-Hex-3-enal		 76.92
C00000356 cis-3-Hexen-1-ol
(Z)-3-hexen-1-ol
(3Z)-3-Hexen-1-ol
cis-3-Hexenol
(Z)-3-Hexenol		 76.92
C00001194 3-(Methylthio)propionic acid 76.92
C00001207 Tiglic acid 76.92
C00001337 GABA
Gamma-aminobutyric acid
4-Aminobutyric acid
gamma-Aminobutyric acid		 76.92
C00001403 Cadaverine 76.92
C00001413 1-Hexanamine
Hexylamine		 76.92
C00019682 Succinaldehydic acid
beta-Formylpropionic acid
4-Oxobutanoic acid		 76.92
C00029460 2-Methyl-2-butenoic acid 76.92
C00029461 2-Methylbutanoic acid
2-Methylbutyric acid		 76.92
C00032371 trans-3-Methylsulfinyl-2-propenol
(+)-trans-3-Methylsulfinyl-2-propenol		 76.92
C00032372 trans-3-Methylthioacrylamide 76.92
C00033555 2-Methyl-1,3-butanediol 76.92
C00035484 2-methylhexane 76.92
C00035617 Ethyl propanoate
Ethyl propionate		 76.92
C00035729 Propyl acetate 76.92
C00036556 3-Methyl-butanamide 76.92
C00043175 2-Methylbutyramide 76.92
C00048963 cis-2-Hexenol
(Z)-2-hexen-1-ol
cis-2-Hexen-1-ol		 76.92
C00015490 Penitricin D 75.00
C00018591 Penitricin
Ro 09-0804		 75.00
C00028706 N-Methylpyrrolidine 75.00
C00034612 N-Methylpyrrolinium
N-Methyl-delta1-pyrrolinium cation		 75.00
C00038233 2-Pyrrolidone
2-Pyrrolidinone		 75.00
C00001218 Caproic acid
1-Hexanoic acid
Hexanoic acid
n-Hexanoic acid		 73.33
C00001254 2-Heptanone
Heptan-2-one
Methyl-n-pentyl ketone		 73.33
C00034880 Heptanal
n-Heptanal		 73.33
C00035700 n-Heptanol 73.33
C00048247 (S)-2-Heptanol 73.33
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