Chem
J-GLOBAL ID：200907018117708159   Nikkaji number：J452.037H

Quercetin 3-(2G-xylosylrutinoside)

クエルセチン3-(2G-キシロシルルチノシド)
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C32H38O20
Molecular formula furigana： C32-H38-O20
Molecular weight： 742.636
InChI： InChI=1S/C32H38O20/c1-9-19(38)23(42)26(45)30(48-9)47-8-17-21(40)24(43)29(52-31-25(44)20(39)15(37)7-46-31)32(50-17)51-28-22(41)18-14(36)5-11(33)6-16(18)49-27(28)10-2-3-12(34)13(35)4-10/h2-6,9,15,17,19-21,23-26,29-40,42-45H,7-8H2,1H3/t9-,15+,17+,19-,20-,21+,23+,24-,25+,26+,29+,30+,31-,32-/m0/s1
InChI key： RLTNQOUWXZXZCS-VMMUDTPISA-N
SMILES： C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](Oc3c(oc4cc(O)cc(O)c4c3=O)c3ccc(O)c(O)c3)[C@H](O[C@@H]3OC[C@@H](O)[C@H](O)[C@H]3O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O
Systematic name  (7)：
  • 3-[[6-O-(6-デオキシ-α-L-マンノピラノシル)-2-O-β-D-キシロピラノシル-β-D-グルコピラノシル]オキシ]-2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-4H-1-ベンゾピラン-4-オン
  • 3-[2-O-β-D-キシロピラノシル-6-O-(α-L-ラムノピラノシル)-β-D-グルコピラノシルオキシ]-3′,4′,5,7-テトラヒドロキシフラボン
  • 3-[(2-O-β-D-キシロピラノシル-6-O-α-L-ラムノピラノシル-β-D-グルコピラノシル)オキシ]-3′,4′,5,7-テトラヒドロキシフラボン
  • 5,7-ジヒドロキシ-2-(3,4-ジヒドロキシフェニル)-3-(2-O-β-D-キシロピラノシル-6-O-α-L-ラムノピラノシル-β-D-グルコピラノシルオキシ)-4H-1-ベンゾピラン-4-オン
  • 3-[(6-O-α-L-ラムノピラノシル-2-O-β-D-キシロピラノシル-β-D-グルコピラノシル)オキシ]-2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-4H-1-ベンゾピラン-4-オン
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Other name (7)：
  • 3-[[6-O-(6-Deoxy-α-L-mannopyranosyl)-2-O-β-D-xylopyranosyl-β-D-glucopyranosyl]oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
  • 3-[2-O-β-D-Xylopyranosyl-6-O-(α-L-rhamnopyranosyl)-β-D-glucopyranosyloxy]-3′,4′,5,7-tetrahydroxyflavone
  • 3-[(2-O-β-D-Xylopyranosyl-6-O-α-L-rhamnopyranosyl-β-D-glucopyranosyl)oxy]-3′,4′,5,7-tetrahydroxyflavone
  • 5,7-Dihydroxy-2-(3,4-dihydroxyphenyl)-3-(2-O-β-D-xylopyranosyl-6-O-α-L-rhamnopyranosyl-β-D-glucopyranosyloxy)-4H-1-benzopyran-4-one
  • 3-[(6-O-α-L-Rhamnopyranosyl-2-O-β-D-xylopyranosyl-β-D-glucopyranosyl)oxy]-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-1-benzopyran-4-one
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CAS registry number： 129235-39-8
KEGG COMPOUND： C10175
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