Chem
J-GLOBAL ID：200907019431245887   Nikkaji number：J781.167E

Gaultherin

ガウルテリン
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： C19H26O12
Molecular formula furigana： C19-H26-O12
Molecular weight： 446.405
InChI： InChI=1S/C19H26O12/c1-27-17(26)8-4-2-3-5-10(8)30-19-16(25)14(23)13(22)11(31-19)7-29-18-15(24)12(21)9(20)6-28-18/h2-5,9,11-16,18-25H,6-7H2,1H3/t9-,11-,12+,13-,14+,15-,16-,18+,19-/m1/s1
InChI key： VHUNCYDAXJGCLO-AHMNSWSSSA-N
SMILES： COC(=O)c1ccccc1O[C@@H]1O[C@H](CO[C@@H]2OC[C@@H](O)[C@H](O)[C@H]2O)[C@@H](O)[C@H](O)[C@H]1O
Systematic name  (7)：
  • 2-(6-O-β-D-キシロピラノシル-β-D-グルコピラノシルオキシ)安息香酸メチル
  • 2-[(6-O-β-D-キシロピラノシル-β-D-グルコピラノシル)オキシ]安息香酸メチル
  • 2-(メトキシカルボニル)フェニル6-O-β-D-キシロピラノシル-β-D-グルコピラノシド
  • 2-[6-O-(β-D-キシロピラノシル)-β-D-グルコピラノシルオキシ]安息香酸メチル
  • 2-(メトキシカルボニル)フェニル6-O-(β-D-キシロピラノシル)-β-D-グルコピラノシド
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Other name (9)：
  • 2-(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyloxy)benzoic acid methyl ester
  • 2-[(6-O-β-D-Xylopyranosyl-β-D-glucopyranosyl)oxy]benzoic acid methyl ester
  • 2-(Methoxycarbonyl)phenyl 6-O-β-D-xylopyranosyl-β-D-glucopyranoside
  • 2-[6-O-(β-D-Xylopyranosyl)-β-D-glucopyranosyloxy]benzoic acid methyl ester
  • ガウルテリン
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CAS registry number： 490-67-5
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