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


and

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




INPUT WORD = C00000301 , 50% or more
[ Metabolite Name : Protoanemonin , Protoanemonene ]
Number of matched data : 56

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00029456 Furfuryl alcohol
2-Furanmethanol
alpha-Furylcarbinol		 92.86
C00030331 Furfural
2-Furaldehyde		 85.71
C00034296 Succinic anhydride
Tetrahydro-2,5-furandione		 85.71
C00048276 2-Methylfuran 85.71
C00043002 Siphonodin 81.25
C00007405 2-Hydroxypyridine 78.57
C00029460 2-Methyl-2-butenoic acid 78.57
C00035617 Ethyl propanoate
Ethyl propionate		 78.57
C00037170 gamma-Pyrone 78.57
C00040580 Tulipalin A 78.57
C00000303 Parasorbic acid 75.00
C00002656 1,4-Benzenediol
Hydroquinone
4-Hydroxyphenol		 75.00
C00048958 Butyl acetate 73.33
C00037933 Triacetic acid lactone 72.22
C00000352 (E)-3-Hexenal 71.43
C00000353 cis-3-Hexenal
(Z)-3-Hexenal
(Z)-Hex-3-enal		 71.43
C00000356 cis-3-Hexen-1-ol
(Z)-3-hexen-1-ol
(3Z)-3-Hexen-1-ol
cis-3-Hexenol
(Z)-3-Hexenol		 71.43
C00001189 3-Methylbutanoic acid
3-Methylbutyric acid
Isovaleric acid		 71.43
C00001207 Tiglic acid 71.43
C00001208 pentanoic acid
Valeric acid		 71.43
C00001308 Ethyl acetate 71.43
C00002664 Phenol 71.43
C00007406 4-Hydroxypyridine 71.43
C00010280 3-Methyl-2-butenoic acid 71.43
C00029461 2-Methylbutanoic acid
2-Methylbutyric acid		 71.43
C00033067 Isovalerate 71.43
C00033555 2-Methyl-1,3-butanediol 71.43
C00035729 Propyl acetate 71.43
C00035792 3-Methyl-1-pentanol
3-Methylbutanol		 71.43
C00048963 cis-2-Hexenol
(Z)-2-hexen-1-ol
cis-2-Hexen-1-ol		 71.43
C00000151 2-Furoic acid 68.75
C00001423 Muscimol 68.75
C00002644 Catechol
Pyrocatechin
Pyrocatechol		 68.75
C00002645 4-Methylphenol
p-Cresol		 68.75
C00002671 Resorcinol 68.75
C00036320 (+)-Tulipalin B 68.75
C00036569 4-Bromophenol 68.75
C00038061 (-)-Tulipalin B 68.75
C00043167 2,3,5-Tribromopyrrole 68.75
C00043859 2-Minaline
Pyrrole-2-carboxylic acid		 68.75
C00001218 Caproic acid
1-Hexanoic acid
Hexanoic acid
n-Hexanoic acid		 66.67
C00001398 L-Valine
L-Val		 66.67
C00007417 Maleate 66.67
C00007623 Ketovaline
2-Ketoisovalerate
alpha-Ketoisovalerate
3-Methyl-2-oxobutanoic acid		 66.67
C00023719 p-Toluquinone 66.67
C00023720 Toluquinol 66.67
C00027734 3,4-Dibromomaleimide 66.67
C00029533 p-Hydroxybenzyl alcohol
4-Hydroxybenzyl alcohol
Gastrodigenin
4-Methylolphenol		 66.67
C00029547 5-Hydroxymethyl-2-furaldehyde
5-(Hydroxymethyl)-2-furaldehyde
5-Hydroxymethyl-2-furfural
5-Hydroxymethylfuraldehyde		 66.67
C00031480 1,2,4-Trihydroxybenzene 66.67
C00034880 Heptanal
n-Heptanal		 66.67
C00035022 4-Methoxyphenol 66.67
C00035500 4-Heptanol 66.67
C00035501 4-Heptanone 66.67
C00037471 Maltol 66.67
C00044037 (2R,3R)-Nilic acid 66.67
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