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


and

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





INPUT WORD = C00035814 , 50% or more
[ Metabolite Name : n-Butanol , Butanol ]
Number of matched data : 63

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00001266 Propanethial S-oxide 88.89
C00001180 Butanoic acid
Butyric acid
81.82
C00007666 3-Hydroxybutyl nitrile 81.82
C00019656 4-Aminobutanal
gamma-Aminobutyraldehyde
81.82
C00035784 1-Pentanol
n-Pentanol
81.82
C00048949 Isovaleraldehyde
3-Methyl-butanal
3-Methylbutanal
81.82
C00007404 1,3-Diaminopropane 77.78
C00007410 (+-)-Propylene glycol
(+-)-1,2-Propanediol
2-Hydroxypropanol
Isopropylene glycol
Propylene glycol
77.78
C00019649 (S)-Lactaldehyde
L-Lactaldehyde
77.78
C00034423 2-Propenoic acid
Propenoic acid
77.78
C00044287 Propionic acid 77.78
C00046784 Isoprene 77.78
C00048479 Methyl acetate 77.78
C00015490 Penitricin D 75.00
C00001163 Glycerol 72.73
C00001297 Triacetylene 72.73
C00001308 Ethyl acetate 72.73
C00001333 beta-Alanine 72.73
C00001428 Putrescine 72.73
C00007413 Glyceraldehyde 72.73
C00035785 pent-1-en-3-one
1-Penten-3-one
72.73
C00035905 2-Methyl-3-buten-2-ol 72.73
C00049006 n-Hexane 72.73
C00000351 trans-2-Hexenal
(2E)-Hexenal
69.23
C00000354 trans-2-Hexenol 69.23
C00000355 trans-3-Hexenol
(E)-3-Hexen-1-ol
(E)-3-Hexenol
69.23
C00000357 Hexanal
n-Hexanal
Hexenal
69.23
C00000358 1-Hexanol
Hexanol
n-Hexanol
69.23
C00001189 3-Methylbutyric acid
Isovaleric acid
3-Methylbutanoic acid
69.23
C00001208 Valeric acid
pentanoic acid
69.23
C00001337 GABA
Gamma-aminobutyric acid
4-Aminobutyric acid
gamma-Aminobutyric acid
69.23
C00018267 (S)-2-Amino-3-butynoic acid
(S)-Ethynylglycine
Antibiotic FR 900130
FR 900130
69.23
C00019675 2-Ketobutyric acid
2-Oxobutyric acid
2-Oxobutanoic acid
alpha-Ketobutyric acid
69.23
C00019682 Succinaldehydic acid
beta-Formylpropionic acid
4-Oxobutanoic acid
69.23
C00029461 2-Methylbutyric acid
2-Methylbutanoic acid
69.23
C00033067 Isovalerate 69.23
C00033555 2-Methyl-1,3-butanediol 69.23
C00035479 2-Hexen-1-ol 69.23
C00035480 2-Hexenal 69.23
C00035493 3-Methyl-2-pentanol 69.23
C00035792 3-Methyl-1-pentanol
3-Methylbutanol
69.23
C00036428 1-Deoxythreitol 69.23
C00036488 2-Hexanol 69.23
C00036546 3-Hexen-1-ol 69.23
C00036556 3-Methyl-butanamide 69.23
C00043175 2-Methylbutyramide 69.23
C00048948 3-Hexenal 69.23
C00001186 Glyoxalic acid
Glyoxylic acid
66.67
C00001196 Monofluoroacetic acid 66.67
C00001267 Propane-1-thiol 66.67
C00001361 Glycine
L-Gly
Gly
66.67
C00007279 2-Aminoethanol
Aminoethanol
Ethanolamine
66.67
C00007409 Ethylene glycol 66.67
C00007461 Glycolic acid 66.67
C00018591 Penitricin
Ro 09-0804
66.67
C00018751 Acrylamidine
NSC 137783
66.67
C00019558 Acetol
Hydroxypropanone
1-Hydroxy-2-propanone
66.67
C00028706 N-Methylpyrrolidine 66.67
C00034612 N-Methylpyrrolinium
N-Methyl-delta1-pyrrolinium cation
66.67
C00038233 2-Pyrrolidone
2-Pyrrolidinone
66.67
C00048304 Acetone 66.67
C00048438 Isopropyl alcohol
Isopropanol
66.67
C00048954 CID is old! 66.67
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