Chem
J-GLOBAL ID：200907010965041490   Nikkaji number：J1.414.243F

Hymenoside A

ヒメノシドA
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： C27H32O11
Molecular formula furigana： C27-H32-O11
Molecular weight： 532.542
InChI： InChI=1S/C27H32O11/c1-16(10-11-28)15-35-27-26(38-23(33)13-18-4-8-20(31)9-5-18)25(24(34)21(14-29)36-27)37-22(32)12-17-2-6-19(30)7-3-17/h2-10,21,24-31,34H,11-15H2,1H3/b16-10+/t21-,24-,25+,26-,27-/m1/s1
InChI key： PNQPOQLVRGUGGA-APTRVCSBSA-N
SMILES： C/C(=C\CO)/CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](OC(=O)Cc2ccc(O)cc2)[C@H]1OC(=O)Cc1ccc(O)cc1
Systematic name  (3)：
  • 1-O-[(E)-2-メチル-4-ヒドロキシ-2-ブテニル]-β-D-グルコピラノース2,3-ビス(4-ヒドロキシフェニルアセタート)
  • (2R,3R,4S,5R,6R)-3-ヒドロキシ-6-{[(2E)-4-ヒドロキシ-2-メチルブタ-2-エン-1-イル]オキシ}-2-(ヒドロキシメチル)-5-{[2-(4-ヒドロキシフェニル)アセチル]オキシ}オキサン-4-イル 2-(4-ヒドロキシフェニル)アセタート
  • (2R,3R,4S,5R,6R)-3-hydroxy-6-{[(2E)-4-hydroxy-2-methylbut-2-en-1-yl]oxy}-2-(hydroxymethyl)-5-{[2-(4-hydroxyphenyl)acetyl]oxy}oxan-4-yl 2-(4-hydroxyphenyl)acetate
Other name (3)：
  • 1-O-[(E)-2-Methyl-4-hydroxy-2-butenyl]-β-D-glucopyranose 2,3-bis(4-hydroxyphenylacetate)
  • ヒメノシドA
  • Hymenoside A
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