Chem
J-GLOBAL ID：200907006024817618   Nikkaji number：J1.451.995E

Hymenoside U

ヒメノシドU
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： C20H26O11
Molecular formula furigana： C20-H26-O11
Molecular weight： 442.417
InChI： InChI=1S/C20H26O11/c1-9-4-11(7-16(25)28-9)29-20-19(18(27)17(26)14(8-21)30-20)31-15(24)6-10-2-3-12(22)13(23)5-10/h2-3,5,9,11,14,17-23,26-27H,4,6-8H2,1H3/t9-,11-,14-,17-,18+,19-,20-/m1/s1
InChI key： XYVFWDDUZMOSCQ-ONALKCFGSA-N
SMILES： C[C@@H]1C[C@H](CC(=O)O1)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1OC(=O)Cc1ccc(O)c(O)c1
Systematic name  (3)：
  • 2-オキソ-6β-メチルテトラヒドロ-2H-ピラン-4α-イル2-O-[2-(3,4-ジヒドロキシフェニル)アセチル]-β-D-グルコピラノシド
  • (2R,3R,4S,5S,6R)-4,5-ジヒドロキシ-6-(ヒドロキシメチル)-2-{[(2R,4R)-2-メチル-6-オキソオキサン-4-イル]オキシ}オキサン-3-イル 2-(3,4-ジヒドロキシフェニル)アセタート
  • (2R,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-{[(2R,4R)-2-methyl-6-oxooxan-4-yl]oxy}oxan-3-yl 2-(3,4-dihydroxyphenyl)acetate
Other name (3)：
  • 2-Oxo-6β-methyltetrahydro-2H-pyran-4α-yl 2-O-[2-(3,4-dihydroxyphenyl)acetyl]-β-D-glucopyranoside
  • ヒメノシドU
  • Hymenoside U
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