Chem
J-GLOBAL ID：200907087349054963   Nikkaji number：J1.893.069B

1-O-Allyl-α-D-mannopyranose 3,4,6-tribenzoate

1-O-アリル-α-D-マンノピラノース3,4,6-トリベンゾアート
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： C30H28O9
Molecular formula furigana： C30-H28-O9
Molecular weight： 532.545
InChI： InChI=1S/C30H28O9/c1-2-18-35-30-24(31)26(39-29(34)22-16-10-5-11-17-22)25(38-28(33)21-14-8-4-9-15-21)23(37-30)19-36-27(32)20-12-6-3-7-13-20/h2-17,23-26,30-31H,1,18-19H2/t23-,24+,25-,26-,30+/m1/s1
InChI key： ZSWCGNLTNCEMHN-URAJONJJSA-N
SMILES： O[C@@H]1[C@@H](OCC=C)O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1OC(=O)c1ccccc1
Systematic name  (4)：
  • 1-O-アリル-α-D-マンノピラノース3,4,6-トリベンゾアート
  • アリル3-O,4-O,6-O-トリベンゾイル-α-D-マンノピラノシド
  • [(2R,3R,4R,5S,6S)-3,4-ビス(ベンゾイルオキシ)-5-ヒドロキシ-6-(プロパ-2-エン-1-イルオキシ)オキサン-2-イル]メチル ベンゾアート
  • [(2R,3R,4R,5S,6S)-3,4-bis(benzoyloxy)-5-hydroxy-6-(prop-2-en-1-yloxy)oxan-2-yl]methyl benzoate
Other name (2)：
  • 1-O-Allyl-α-D-mannopyranose 3,4,6-tribenzoate
  • Allyl 3-O,4-O,6-O-tribenzoyl-α-D-mannopyranoside
Thsaurus map：
Thesaurus Map

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