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


and

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




INPUT WORD = C00004500 , 50% or more
[ Metabolite Name : Isoscutellarein 4'-methyl ether 8-(2''-sulfatoglucuronide) , 5,7-Dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl beta-D-glucopyranosiduronic acid 2-(hydrogen sulfate) ]
Number of matched data : 51

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00004435 8-Hydroxyluteolin 4'-methyl ether 8-glucoside-3'-sulfate 96.20
C00004498 8-Hydroxyapigenin 8-(2''-sulfatoglucuronide) 96.20
C00045107 Theograndin I
(+)-Theograndin I		 94.94
C00045108 Theograndin II
(+)-Theograndin II		 94.94
C00006073 Tamarixetin 3-glucoside-7-sulfate
Quercetin 4'-methyl ether 3-glucoside-7-sulfate
3-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(3-hydroxy-4-methoxyphenyl)-7-(sulfooxy)-4H-1-benzopyran-4-one		 93.67
C00006075 Gossypetin 8-glucoside-3-sulfate 93.67
C00006072 Isorhamnetin 3-glucuronide-7-sulfate 92.59
C00006076 Gossypetin 8-glucuronide-3-sulfate 92.59
C00004253 Isoscutellarein 4'-methyl ether 8-(2''-sulfatoglucoside) 92.41
C00004427 8-Hydroxyluteolin 8-glucoside-3'-sulfate 92.41
C00006069 Quercetin 3-glucuronide-7-sulfate 92.41
C00013701 Hypolaetin 7-sulfate-8-glucoside
8-Hydroxyluteolin 7-sulfate-8-glucoside
2-(3,4-Dihydroxyphenyl)-8-(beta-D-glucopyranosyloxy)-5-hydroxy-7-(sulfooxy)-4H-1-benzopyran-4-one		 92.41
C00006074 Patuletin 3-glucoside-7-sulfate 91.36
C00006063 Kaempferol 3-(3''-sulfatoglucoside) 91.14
C00006065 Kaempferol 3-glucuronide-7-sulfate 91.14
C00013898 Quercetin 3-glucoside-3'-sulfate
3-(beta-D-Glucopyranosyloxy)-5,7-dihydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4H-1-benzopyran-4-one		 91.14
C00036891 Centabractein 91.14
C00004327 Luteolin 7-sulfate-3'-glucoside 89.87
C00005840 Kaempferol 3-(6''-malonylgalactoside) 89.87
C00005844 Kaempferol 3-(6''-malonylglucoside)
6''-Malonylastragalin		 89.87
C00006021 Patuletin 3-(6''-acetylglucoside) 89.87
C00006064 Kaempferol 3-beta-(6''-sulfatoglucoside) 89.87
C00006068 Quercetin 3-(3''-sulfatoglucoside) 89.87
C00006070 Quercetin 3-glucuronide-3'-sulfate 89.87
C00013646 Isoscutellarein 4'-methyl ether 8-(6''-n-butylglucuronide)
5,7-Dihydroxy-2-(4-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl beta-D-glucopyranosiduronic acid butyl ester		 89.87
C00013671 Thalassiolin A
Luteorin 7-(2''-sulfatoglucoside)
2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-[(2-O-sulfo-beta-D-glucopyranosyl)oxy]-4H-1-benzopyran-4-one		 89.87
C00013866 Parthenosin
Quercetin 3-(6''-n-butylglucuronide)
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl beta-D-glucopyranosiduronic acid butyl ester		 89.87
C00013644 8-Hydroxyapigenin 8-(2'',4''-disulfatoglucuronide)
5,7-Dihydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-1-benzopyran-8-yl beta-D-Glucopyranosiduronic acid 2,4-bis(hydrogen sulfate)		 89.41
C00004174 Apigenin 5-(6''-malonylglucoside) 88.61
C00004182 Apigenin 7-(2''-glucuronosyllactate) 88.61
C00004200 Apigenin 7-methyl ether 5-(6''-malonylglucoside) 88.61
C00004251 Isoscutellarein 4'-methyl ether 8-glucuronide 88.61
C00004314 Luteolin 5-(6''-malonylglucoside) 88.61
C00004322 Luteolin 7-(2''-glucuronosyllactate) 88.61
C00004376 Luteolin 3',4'-dimethyl ether 7-glucuronide 88.61
C00004434 8-Hydroxyluteolin 4'-methyl ether 8-glucuronide 88.61
C00004481 5,6,7-Trihydroxyflavone 7-(6''-malonylglucoside) 88.61
C00004519 8-Hydroxyluteolin 3'-methyl ether 8-glucuronide
8-Hydroxychrysoeriol 8-glucuronide
5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxo-4H-1-benzopyran-8-yl beta-D-glucopyranosiduronic acid		 88.61
C00005779 Syringetin 3-glucuronide 88.61
C00005787 Isolimocitrol 3-glucoside 88.61
C00005799 5,3',4'-Trihydroxy-3-methoxy-6,7-methylenedioxyflavone 4'-glucuronide 88.61
C00005941 Herbacetin 8-(2'',3''-diacetylxyloside) 88.61
C00006003 Isorhamnetin 3-(6''-acetylgalactoside) 88.61
C00006004 Isorhamnetin 3-(2''-acetylglucoside) 88.61
C00006034 Haploside A 88.61
C00006048 Laricitrin 3-(6''-acetylglucoside) 88.61
C00006755 Pelargonidin 3-(6''-malonylglucoside) 88.61
C00006796 Cyanidin 3-(6''-malonylglucoside)
Cyanidin-3-O-(6-O-malonyl-beta-D-glucopyranoside)		 88.61
C00013640 Scutellarein 6,4'-dimethyl ether 7-(6''-acetylglucoside)
Lantanoside
7-[(6-O-Acetyl-beta-D-glucopyranosyl)oxy]-5-hydroxy-6-methoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one		 88.61
C00013862 Quercetin 3-(4''-malonylrhamnoside)
3-[[4-O-(Carboxyacetyl)-6-deoxy-alpha-L-mannopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one		 88.61
C00050101 Galangin 3-O-beta-D-glucoside-8-sulfonate
(-)-Galangin 3-O-beta-D-glucoside-8-sulfonate		 88.61
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