Chem
J-GLOBAL ID：200907004755893817   Nikkaji number：J2.345.022D

1-[3-(4-Methoxyphenyl)-1,2,4-oxadiazole-5-yl]-1-deoxy-β-D-glucopyranose tetrabenzoate

1-[3-(4-メトキシフェニル)-1,2,4-オキサジアゾール-5-イル]-1-デオキシ-β-D-グルコピラノーステトラベンゾアート
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： C43H34N2O11
Molecular formula furigana： C43-H34-N2-O11
Molecular weight： 754.748
InChI： InChI=1S/C43H34N2O11/c1-50-32-24-22-27(23-25-32)38-44-39(56-45-38)37-36(55-43(49)31-20-12-5-13-21-31)35(54-42(48)30-18-10-4-11-19-30)34(53-41(47)29-16-8-3-9-17-29)33(52-37)26-51-40(46)28-14-6-2-7-15-28/h2-25,33-37H,26H2,1H3/t33-,34-,35+,36-,37-/m1/s1
InChI key： JIEXRMYYAWVEPT-KHKVHWIZSA-N
SMILES： COc1ccc(cc1)c1noc(n1)[C@@H]1O[C@H](COC(=O)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1
Systematic name  (3)：
  • 1-[3-(4-メトキシフェニル)-1,2,4-オキサジアゾール-5-イル]-1-デオキシ-β-D-グルコピラノーステトラベンゾアート
  • [(2R,3R,4S,5R,6R)-3,4,5-トリス(ベンゾイルオキシ)-6-[3-(4-メトキシフェニル)-1,2,4-オキサジアゾール-5-イル]オキサン-2-イル]メチル ベンゾアート
  • [(2R,3R,4S,5R,6R)-3,4,5-tris(benzoyloxy)-6-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]oxan-2-yl]methyl benzoate
Other name (1)：
  • 1-[3-(4-Methoxyphenyl)-1,2,4-oxadiazole-5-yl]-1-deoxy-β-D-glucopyranose tetrabenzoate
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