Chem
J-GLOBAL ID：201607013865600585   Nikkaji number：J3.469.060J

6-O-Octanoyl-α-D-glucopyranosyl α-D-glucopyranoside

6-O-オクタノイル-α-D-グルコピラノシルα-D-グルコピラノシド
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： C20H36O12
Molecular formula furigana： C20-H36-O12
Molecular weight： 468.496
InChI： InChI=1S/C20H36O12/c1-2-3-4-5-6-7-12(22)29-9-11-14(24)16(26)18(28)20(31-11)32-19-17(27)15(25)13(23)10(8-21)30-19/h10-11,13-21,23-28H,2-9H2,1H3/t10-,11-,13-,14-,15+,16+,17-,18-,19-,20-/m1/s1
InChI key： WNPJPTWSRIRPIJ-JFRFVCMESA-N
SMILES： CCCCCCCC(=O)OC[C@H]1O[C@H](O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@@H](O)[C@@H]1O
Systematic name  (3)：
  • 6-O-オクタノイル-α-D-グルコピラノシルα-D-グルコピラノシド
  • [(2R,3S,4S,5R,6R)-3,4,5-トリヒドロキシ-6-{[(2R,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}オキサン-2-イル]メチル オクタノアート
  • [(2R,3S,4S,5R,6R)-3,4,5-trihydroxy-6-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methyl octanoate
Other name (1)：
  • 6-O-Octanoyl-α-D-glucopyranosyl α-D-glucopyranoside
Thsaurus map：
Thesaurus Map

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