Chem
J-GLOBAL ID：200907031823184851   Nikkaji number：J2.134.015D

Cucurbitoside A

ククルビトシド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： C26H32O12
Molecular formula furigana： C26-H32-O12
Molecular weight： 536.530
InChI： InChI=1S/C26H32O12/c27-11-10-15-6-8-17(9-7-15)36-24-21(20(30)19(29)18(12-28)37-24)38-25-22(31)26(33,14-35-25)13-34-23(32)16-4-2-1-3-5-16/h1-9,18-22,24-25,27-31,33H,10-14H2/t18-,19-,20+,21-,22+,24-,25+,26-/m1/s1
InChI key： MNMYNECIAXCLHN-JUKYQPCLSA-N
SMILES： OCCc1ccc(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[C@@H]2OC[C@](O)(COC(=O)c3ccccc3)[C@H]2O)cc1
Systematic name  (4)：
  • 4-[2-O-(5-O-ベンゾイル-D-アピオ-β-D-フラノシル)-β-D-グルコピラノシルオキシ]フェネチルアルコール
  • 4-(2-ヒドロキシエチル)フェニル2-O-(5-O-ベンゾイル-D-アピオ-β-D-フラノシル)-β-D-グルコピラノシド
  • [(3S,4R,5S)-5-{[(2S,3R,4S,5S,6R)-4,5-ジヒドロキシ-2-[4-(2-ヒドロキシエチル)フェノキシ]-6-(ヒドロキシメチル)オキサン-3-イル]オキシ}-3,4-ジヒドロキシオキソラン-3-イル]メチル ベンゾアート
  • [(3S,4R,5S)-5-{[(2S,3R,4S,5S,6R)-4,5-dihydroxy-2-[4-(2-hydroxyethyl)phenoxy]-6-(hydroxymethyl)oxan-3-yl]oxy}-3,4-dihydroxyoxolan-3-yl]methyl benzoate
Other name (4)：
  • 4-[2-O-(5-O-Benzoyl-D-apio-β-D-furanosyl)-β-D-glucopyranosyloxy]phenethyl alcohol
  • ククルビトシドA
  • Cucurbitoside A
  • 4-(2-Hydroxyethyl)phenyl 2-O-(5-O-benzoyl-D-apio-β-D-furanosyl)-β-D-glucopyranoside
Thsaurus map：
Thesaurus Map

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