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


and

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




INPUT WORD = C00045107 , 50% or more
[ Metabolite Name : Theograndin I , (+)-Theograndin I ]
Number of matched data : 79

CID Metabolite Name Structural formula Metabolite Activity Similarity (%)
C00004498 8-Hydroxyapigenin 8-(2''-sulfatoglucuronide) 98.70
C00045108 Theograndin II
(+)-Theograndin II		 97.47
C00004427 8-Hydroxyluteolin 8-glucoside-3'-sulfate 96.10
C00006063 Kaempferol 3-(3''-sulfatoglucoside) 96.10
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		 96.10
C00004500 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)		 94.94
C00004327 Luteolin 7-sulfate-3'-glucoside 94.81
C00006065 Kaempferol 3-glucuronide-7-sulfate 94.81
C00006068 Quercetin 3-(3''-sulfatoglucoside) 94.81
C00006076 Gossypetin 8-glucuronide-3-sulfate 93.83
C00004435 8-Hydroxyluteolin 4'-methyl ether 8-glucoside-3'-sulfate 93.67
C00006069 Quercetin 3-glucuronide-7-sulfate 93.67
C00006075 Gossypetin 8-glucoside-3-sulfate 93.67
C00005941 Herbacetin 8-(2'',3''-diacetylxyloside) 93.51
C00006064 Kaempferol 3-beta-(6''-sulfatoglucoside) 93.51
C00006072 Isorhamnetin 3-glucuronide-7-sulfate 92.59
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		 92.41
C00004253 Isoscutellarein 4'-methyl ether 8-(2''-sulfatoglucoside) 92.21
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		 92.21
C00005641 Patuletin 3-glucuronide 92.21
C00005691 Gossypetin 8-glucuronide 92.21
C00005945 Quercetin 3-(3''-acetylgalactoside) 92.21
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		 92.21
C00013903 Quercetin 3-methyl ether 5-glucoside-3'-sulfate 91.14
C00004175 Apigenin 7-(6''-malonylglucoside) 90.91
C00004434 8-Hydroxyluteolin 4'-methyl ether 8-glucuronide 90.91
C00004439 5,8,3',4'-Tetrahydroxy-6,7-dimethoxyflavone 8-glucoside 90.91
C00004470 8-Hydroxytricetin 7-glucuronide 90.91
C00005318 6-Methoxykaempferol 3-glucuronide 90.91
C00005343 Herbacetin 8-glucuronide 90.91
C00005731 Myricetin 3-glucuronide
Myricetin 3-O-beta-D-glucuronide		 90.91
C00005779 Syringetin 3-glucuronide 90.91
C00006086 Isoorientin 7-O-sulfate 90.91
C00006088 Isovitexin 7-O-sulfate 90.91
C00013731 3,5,7-Trihydroxyflavone 3-glucoside-8-sulfate
3-(beta-D-Glucopyranosyloxy)-5,7-dihydroxy-4-oxo-2-phenyl-4H-1-benzopyran-8-sulfonic acid		 90.91
C00013865 Quercetin 3-(2''-acetylgalactoside)
3-[(2-O-Acetyl-beta-D-galactopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one		 90.91
C00019386 Genistein 8-C-glucoside 6''-O-malonate
5,7,4'-Trihydroxyisoflavone 8-C-(6''-malonylglucoside)		 90.91
C00030799 CID is old! 90.91
C00050101 Galangin 3-O-beta-D-glucoside-8-sulfonate
(-)-Galangin 3-O-beta-D-glucoside-8-sulfonate		 90.91
C00005840 Kaempferol 3-(6''-malonylgalactoside) 89.87
C00005844 Kaempferol 3-(6''-malonylglucoside)
6''-Malonylastragalin
Kaempferol 3-o-beta-D-(6''-o-malonyl)-glucoside		 89.87
C00013779 Kaempferol 3-(3'',4''-diacetylglucoside) 89.87
C00004174 Apigenin 5-(6''-malonylglucoside) 89.61
C00004179 Apigenin 7-(2''-acetyl-6''-methylglucuronide) 89.61
C00004188 Apigenin 7-(2'',3''-diacetylglucoside) 89.61
C00004189 Apigenin 7-(3'',4''-diacetylglucoside) 89.61
C00004246 Isoscutellarein 8-glucuronide 89.61
C00004251 Isoscutellarein 4'-methyl ether 8-glucuronide 89.61
C00004381 6-Hydroxyluteolin 6-glucuronide 89.61
C00004420 8-Hydroxyluteolin 8-glucuronide 89.61
C00004481 5,6,7-Trihydroxyflavone 7-(6''-malonylglucoside) 89.61
C00004513 6-Methoxyluteolin 7-glucuronide 89.61
C00004514 6-Methoxyluteolin 7-glucuronide methyl ester 89.61
C00005142 Kaempferol 3-(6''-ethylglucuronide) 89.61
C00005376 Miquelianin
Quercetin 3-O-beta-D-glucuronide
Quercetin 3-O-glucuronide
Quercetin 3-O-beta-D-glucuronopyranoside		 89.61
C00005378 Quercetin 3-(6''-ethylglucuronide) 89.61
C00005493 Quercetin 3-methyl ether 7-glucuronide 89.61
C00005501 Azaleatin 3-glucuronide 89.61
C00005652 Quercetagetin 3'-methyl ether 3-galactoside 89.61
C00005653 Quercetagetin 3'-methyl ether 3-glucoside 89.61
C00005658 Tomentin 6-glucoside 89.61
C00005663 Eupatolitin 3-galactoside 89.61
C00005666 Spinacetin 3-O-beta-glucopyranoside
Spinacetin 3-glucoside		 89.61
C00005704 Corniculatusin 3-galactoside 89.61
C00005711 Gossypetin 7,8-dimethyl ether 3-glucoside
2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-5-hydroxy-7,8-dimethoxy-4H-1-benzopyran-4-one		 89.61
C00005714 Limocitrin 3-galactoside 89.61
C00005715 Limocitrin 3-O-beta-D-glucopyranoside
Limocitrin 3-O-beta-glucopyranoside
Limocitrin 3-glucoside		 89.61
C00005761 Laricitrin 3-glucoside 89.61
C00005776 Syringetin 3-galactoside 89.61
C00005843 6''-O-Acetylastragalin
Kaempferol 3-(6''-acetylglucoside)		 89.61
C00006003 Isorhamnetin 3-(6''-acetylgalactoside) 89.61
C00006084 Orientin 7-O-sulfate 89.61
C00006087 Vitexin 7-O-sulfate 89.61
C00006755 Pelargonidin 3-(6''-malonylglucoside) 89.61
C00013703 Isothymusin 8-glucoside
8-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-(4-hydroxyphenyl)-6,7-dimethoxy-4H-1-benzopyran-4-one		 89.61
C00013714 Tricetin 3'-methyl ether 7-glucuronide
2-(3,4-Dihydroxy-5-methoxyphenyl)-5-hydroxy-4-oxo-4H-1-benzopyran-7-yl beta-D-glucopyranosiduronic acid		 89.61
C00013898 Quercetin 3-glucoside-3'-sulfate
3-(beta-D-Glucopyranosyloxy)-5,7-dihydroxy-2-[4-hydroxy-3-(sulfooxy)phenyl]-4H-1-benzopyran-4-one		 89.61
C00013957 Quercetagetin 7,3'-dimethyl ether 6-glucoside
6-(beta-D-Glucopyranosyloxy)-3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4H-1-benzopyran-4-one		 89.61
C00035656 Hypolaetin 7-O-glucuronide 89.61
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