Chem
J-GLOBAL ID:200907092523900880   Nikkaji number:J501.085C

Multinoside A acetate

ムルチノシドAアセタート
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: C29H32O17
Molecular formula furigana: C29-H32-O17
Molecular weight: 652.558
InChI: InChI=1S/C29H32O17/c1-9-25(45-29-23(39)21(37)19(35)17(44-29)8-41-10(2)30)22(38)24(40)28(42-9)46-27-20(36)18-15(34)6-12(31)7-16(18)43-26(27)11-3-4-13(32)14(33)5-11/h3-7,9,17,19,21-25,28-29,31-35,37-40H,8H2,1-2H3/t9-,17+,19+,21-,22-,23+,24+,25-,28-,29-/m0/s1
InChI key: AATRYBSLZLJIJX-MNMPECKNSA-N
SMILES: C[C@@H]1O[C@@H](Oc2c(oc3cc(O)cc(O)c3c2=O)c2ccc(O)c(O)c2)[C@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@H](COC(=O)C)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (4):
  • 3-[[4-O-(6-O-アセチル-β-D-グルコピラノシル)-α-L-ラムノピラノシル]オキシ]-3′,4′,5,7-テトラヒドロキシフラボン
  • 3-[4-O-(6-O-アセチル-β-D-グルコピラノシル)-α-L-ラムノピラノシルオキシ]-3′,4′,5,7-テトラヒドロキシフラボン
  • [(2R,3S,4S,5R,6S)-6-{[(2S,3R,4S,5R,6S)-6-{[2-(3,4-ジヒドロキシフェニル)-5,7-ジヒドロキシ-4-オキソ-4H-クロメン-3-イル]オキシ}-4,5-ジヒドロキシ-2-メチルオキサン-3-イル]オキシ}-3,4,5-トリヒドロキシオキサン-2-イル]メチル アセタート
  • [(2R,3S,4S,5R,6S)-6-{[(2S,3R,4S,5R,6S)-6-{[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl]oxy}-4,5-dihydroxy-2-methyloxan-3-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl acetate
Other name (4):
  • ムルチノシドAアセタート
  • Multinoside A acetate
  • 3-[[4-O-(6-O-Acetyl-β-D-glucopyranosyl)-α-L-rhamnopyranosyl]oxy]-3′,4′,5,7-tetrahydroxyflavone
  • 3-[4-O-(6-O-Acetyl-β-D-glucopyranosyl)-α-L-rhamnopyranosyloxy]-3′,4′,5,7-tetrahydroxyflavone
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