Chem
J-GLOBAL ID:200907034367656524   Nikkaji number:J1.411.240E

4-O-α-D-Glucopyranosyl-6-O-methyl-β-D-glucopyranose heptaacetate

4-O-α-D-グルコピラノシル-6-O-メチル-β-D-グルコピラノースヘプタアセタート
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: C27H38O18
Molecular formula furigana: C27-H38-O18
Molecular weight: 650.583
InChI: InChI=1S/C27H38O18/c1-11(28)36-10-19-20(37-12(2)29)22(38-13(3)30)25(41-16(6)33)27(44-19)45-21-18(9-35-8)43-26(42-17(7)34)24(40-15(5)32)23(21)39-14(4)31/h18-27H,9-10H2,1-8H3/t18-,19-,20-,21-,22+,23+,24-,25-,26-,27-/m1/s1
InChI key: JMGPBPJRUNSLEF-DVCSACCXSA-N
SMILES: COC[C@H]1O[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@@H](OC(=O)C)[C@@H]1O[C@H]1O[C@H](COC(=O)C)[C@@H](OC(=O)C)[C@H](OC(=O)C)[C@H]1OC(=O)C
Systematic name  (4):
  • アセチル4-O-(2-O,3-O,4-O,6-O-テトラアセチル-α-D-グルコピラノシル)-2-O,3-O-ジアセチル-6-O-メチル-β-D-グルコピラノシド
  • 4-O-α-D-グルコピラノシル-6-O-メチル-β-D-グルコピラノースヘプタアセタート
  • [(2R,3R,4S,5R,6R)-3,4,5-トリス(アセチルオキシ)-6-{[(2R,3R,4S,5R,6S)-4,5,6-トリス(アセチルオキシ)-2-(メトキシメチル)オキサン-3-イル]オキシ}オキサン-2-イル]メチル アセタート
  • [(2R,3R,4S,5R,6R)-3,4,5-tris(acetyloxy)-6-{[(2R,3R,4S,5R,6S)-4,5,6-tris(acetyloxy)-2-(methoxymethyl)oxan-3-yl]oxy}oxan-2-yl]methyl acetate
Other name (3):
  • Acetyl 4-O-(2-O,3-O,4-O,6-O-tetraacetyl-α-D-glucopyranosyl)-2-O,3-O-diacetyl-6-O-methyl-β-D-glucopyranoside
  • 4-O-α-D-Glucopyranosyl-6-O-methyl-β-D-glucopyranose heptaacetate
  • 4-O-(α-D-glucopyranosyl)-6-O-methyl-β-D-glucopyranose heptaacetate
CAS registry number: 28810-06-2
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