"Twins" retrives similar metabolites in chemical structure.
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"Twins" retrives similar metabolites in chemical structure. |
| last update : 2020.01.06 |
| INPUT WORD = C00013646 , 50% or more |
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| [ Metabolite Name : 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 ] | |
| Number of matched data : 57 | |
| CID | Metabolite Name | Structural formula | Metabolite Activity | Similarity (%) |
|---|---|---|---|---|
| C00004352 | Luteolin 3'-methyl ether 7-(6''-crotonylglucoside) |  |
91.14 | C00004200 | Apigenin 7-methyl ether 5-(6''-malonylglucoside) |  |
89.87 | 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) |
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89.87 | C00010117 | Bichanin A 7-O-glucoside-6''-malonate Biochanin A 7-O-beta-D-glucoside-6''-O-malonate |
 |
89.87 | C00004174 | Apigenin 5-(6''-malonylglucoside) |  |
89.74 | C00004175 | Apigenin 7-(6''-malonylglucoside) |  |
 |
89.74 | C00004182 | Apigenin 7-(2''-glucuronosyllactate) |  |
89.74 | C00010110 | Genistein 7-O-beta-D-glucoside 6''-O-malonate Genistein 7-O-glucoside-6''-malonate Malonylgenistin |
 |
89.74 | 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 |
 |
89.74 | C00014087 | 2''-O-(2'''-Methylbutyryl)vitexin Vitexin 2''-O-(2'''-methylbutyryl) |
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89.74 | C00018999 | 2'',6''-O-Diacetyloninin 7-Hydroxy-4'-methoxyisoflavone 7-O-(2'',6''-diacetylglucoside) |
 |
89.74 | C00019386 | Genistein 8-C-glucoside 6''-O-malonate 5,7,4'-Trihydroxyisoflavone 8-C-(6''-malonylglucoside) |
 |
89.74 | C00004490 | Scutellarein 4'-methyl ether 7-(2'',6''-diacetylalloside) |  |
88.89 | C00006007 | Isorhamnetin 3-[6''-(2-(E)-butenoyl)-glucoside] (E)-5,7-Dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-3-[[6-O-(1-oxo-2-butenyl)-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one |
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88.89 | C00001067 | Luteolin 7-O-(6''-malonylglucoside) |  |
|
88.61 | C00004314 | Luteolin 5-(6''-malonylglucoside) |  |
88.61 | C00004435 | 8-Hydroxyluteolin 4'-methyl ether 8-glucoside-3'-sulfate |  |
88.61 | C00006034 | Haploside A |  |
88.61 | C00006162 | Orientin 2'',6''-diacetate |  |
88.61 | C00006163 | Isoorientin 2'',6''-diacetate 2'',6''-Di-O-acetylisoorientin |
 |
88.61 | C00006371 | 5,7-Dihydroxy-8,3',4',5'-tetramethoxyflavone 6-C-glucoside |  |
88.61 | C00010139 | Isocaviunin 7-O-glucoside Isocaviudin |
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88.61 | C00013668 | Luteolin 7-glucoside-4'-(Z-2-methyl-2-butenoate) 7-(beta-D-Glucopyranosyloxy)-5-hydroxy-2-[3-hydroxy-4-[[(2Z)-2-methyl-1-oxo-2-butenyl]oxy]phenyl]-4H-1-benzopyran-4-one |
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88.61 | C00013779 | Kaempferol 3-(3'',4''-diacetylglucoside) |  |
88.61 | 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 |
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88.61 | C00014094 | Isoswertisin 2''-O-(2'''-methylbutyrate) |  |
88.61 | C00004179 | Apigenin 7-(2''-acetyl-6''-methylglucuronide) |  |
88.46 | C00004189 | Apigenin 7-(3'',4''-diacetylglucoside) |  |
88.46 | C00004204 | Acacetin 7-(6''-methylglucuronide) |  |
88.46 | C00004208 | Acacetin 7-(2''-acetylglucoside) Isoagastachoside |
 |
88.46 | C00004209 | Apigenin 7-(6''-crotonylglucoside) |  |
88.46 | C00004245 | Acacetin 7-(6''-acetylglucoside) |  |
88.46 | C00004254 | Isoscutellarein 8,4'-dimethyl ether 7-glucuronide |  |
88.46 | C00005818 | Icariside II Baohuoside 1 3-[(6-Deoxy-alpha-L-mannopyranosyl)oxy]-5,7-dihydroxy-2-(4-methoxyphenyl)-8-(3-methyl-2-butenyl)-4H-1-benzopyran-4-one |
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88.46 | C00005865 | Kaempferol 3-(2'',4''-diacetylrhamnoside) |  |
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88.46 | C00005941 | Herbacetin 8-(2'',3''-diacetylxyloside) |  |
88.46 | C00006003 | Isorhamnetin 3-(6''-acetylgalactoside) |  |
88.46 | C00006161 | Scoparin 6''-acetate |  |
88.46 | C00014079 | 2'',6''-Di-O-Acetyl isovitexin |  |
88.46 | C00019255 | Genisteone 5,7,4'-Trihydroxy-6-prenylisoflavone 7-O-glucoside |
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88.46 | C00019756 | Daidzein 7-O-(6''-succinylglucoside) 7,4'-Dihydroxyisoflavone 7-O-(6''-succinylglucoside) |
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88.46 | C00004353 | Luteolin 3'-methyl ether 7-malonylglucoside |  |
87.65 | C00004364 | Luteolin 4'-methyl ether 7-(6''-malonylglucoside) |  |
87.65 | C00005871 | Kaempferol 7-(6''-p-succinylglucoside) |  |
87.65 | C00019758 | Glycitein 7-O-(6''-succinylglucoside) 7,4'-Dihydroxy-6-methoxyisoflavone 7-O-(6''-succinylglucoside) |
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87.65 | C00031858 | Hirsutissimiside A (-)-Hirsutissimiside A Formononetin 7-O-n(6''-ethylmalonyl)-glucopyranoside |
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87.65 | C00004503 | Luteolin 7-[6''-(2-methylbutyryl)glucoside] 2-(3,4-Dihydroxyphenyl)-5-hydroxy-7-[[6-O-(2-methyl-1-oxobutyl)-beta-D-glucopyranosyl]oxy]-4H-1-benzopyran-4-one |
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87.34 | C00005724 | Chrysosplenoside E |  |
87.34 | C00005840 | Kaempferol 3-(6''-malonylgalactoside) |  |
87.34 | C00005844 | Kaempferol 3-(6''-malonylglucoside) 6''-Malonylastragalin |
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87.34 | C00006018 | Rhamnazin 3-(6''-acetylglucoside) |  |
87.34 | C00006021 | Patuletin 3-(6''-acetylglucoside) |  |
87.34 | C00008053 | 6,7,3',4'-Tetrahydroxyaurone 6-(4'',6''-diacetylglucoside) |  |
87.34 | 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 |
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87.34 | C00014095 | 2''-O-(2'''-Methylbutyryl)isoswertisin 3''-O-2-Methylbutyrylisoswertisin Isoswertisin 3''-O-(2'''-methylbutyrate) |
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87.34 | C00014105 | 2''-O-(2'''-Methylbutyryl)orientin Orientin 2''-O-(2'''-methylbutyrate) |
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87.34 | C00019704 | 2'-Hydroxygenistein 7-O-(6''-malonylglucoside) 5,7,2',4'-Tetrahydroxyisoflavone 7-O-(6''-malonylglucoside) |
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87.34 |