Chem
J-GLOBAL ID:200907025288880525   Nikkaji number:J2.393.849I

6,8-Di(β-D-glucopyranosyloxy)-1,2-dihydroxyxanthone

6,8-ジ(β-D-グルコピラノシルオキシ)-1,2-ジヒドロキシキサントン
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: C25H28O16
Molecular formula furigana: C25-H28-O16
Molecular weight: 584.483
InChI: InChI=1S/C25H28O16/c26-5-12-17(30)20(33)22(35)24(40-12)37-7-3-10-14(19(32)15-9(38-10)2-1-8(28)16(15)29)11(4-7)39-25-23(36)21(34)18(31)13(6-27)41-25/h1-4,12-13,17-18,20-31,33-36H,5-6H2/t12-,13-,17-,18-,20+,21+,22-,23-,24-,25-/m1/s1
InChI key: HCWVCVOBHMKYBN-AVZLMCBGSA-N
SMILES: OC[C@H]1O[C@@H](Oc2cc(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c3c(c2)oc2ccc(O)c(O)c2c3=O)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3):
  • 6,8-ジ(β-D-グルコピラノシルオキシ)-1,2-ジヒドロキシキサントン
  • 1,2-ジヒドロキシ-6,8-ビス({[(2S,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ})-9H-キサンテン-9-オン
  • 1,2-dihydroxy-6,8-bis({[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy})-9H-xanthen-9-one
Other name (1):
  • 6,8-Di(β-D-glucopyranosyloxy)-1,2-dihydroxyxanthone
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