Chem
J-GLOBAL ID：200907098671524730   Nikkaji number：J1.893.061G

1-O-Allyl-2-O,3-O-dibenzoyl-β-D-glucopyranuronic acid methyl ester

1-O-アリル-2-O,3-O-ジベンゾイル-β-D-グルコピラヌロン酸メチル
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： C24H24O9
Molecular formula furigana： C24-H24-O9
Molecular weight： 456.447
InChI： InChI=1S/C24H24O9/c1-3-14-30-24-20(32-22(27)16-12-8-5-9-13-16)18(17(25)19(33-24)23(28)29-2)31-21(26)15-10-6-4-7-11-15/h3-13,17-20,24-25H,1,14H2,2H3/t17-,18-,19-,20+,24+/m0/s1
InChI key： ICBYYTDVVFQQQT-AIBQHXCESA-N
SMILES： COC(=O)[C@H]1O[C@@H](OCC=C)[C@H](OC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@@H]1O
Systematic name  (3)：
  • 1-O-アリル-2-O,3-O-ジベンゾイル-β-D-グルコピラヌロン酸メチル
  • メチル (2S,3S,4S,5R,6R)-4,5-ビス(ベンゾイルオキシ)-3-ヒドロキシ-6-(プロパ-2-エン-1-イルオキシ)オキサン-2-カルボキシラート
  • methyl (2S,3S,4S,5R,6R)-4,5-bis(benzoyloxy)-3-hydroxy-6-(prop-2-en-1-yloxy)oxane-2-carboxylate
Other name (1)：
  • 1-O-Allyl-2-O,3-O-dibenzoyl-β-D-glucopyranuronic acid methyl ester
Thsaurus map：
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