Chem
J-GLOBAL ID：200907066429230668   Nikkaji number：J2.079.822J

Hexyl 2-O,3-O,4-O-tribenzoyl-6-O-trityl-β-D-glucopyranoside

ヘキシル2-O,3-O,4-O-トリベンゾイル-6-O-トリチル-β-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： C52H50O9
Molecular formula furigana： C52-H50-O9
Molecular weight： 818.963
InChI： InChI=1S/C52H50O9/c1-2-3-4-23-36-56-51-47(61-50(55)40-28-15-7-16-29-40)46(60-49(54)39-26-13-6-14-27-39)45(59-48(53)38-24-11-5-12-25-38)44(58-51)37-57-52(41-30-17-8-18-31-41,42-32-19-9-20-33-42)43-34-21-10-22-35-43/h5-22,24-35,44-47,51H,2-4,23,36-37H2,1H3/t44-,45-,46+,47-,51-/m1/s1
InChI key： DCFOFLKVIXRWMP-QQUSVZLISA-N
SMILES： CCCCCCO[C@@H]1O[C@H](COC(c2ccccc2)(c2ccccc2)c2ccccc2)[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1
Systematic name  (3)：
  • ヘキシル2-O,3-O,4-O-トリベンゾイル-6-O-トリチル-β-D-グルコピラノシド
  • (2R,3R,4S,5R,6R)-4,5-ビス(ベンゾイルオキシ)-6-(ヘキシルオキシ)-2-[(トリフェニルメトキシ)メチル]オキサン-3-イル ベンゾアート
  • (2R,3R,4S,5R,6R)-4,5-bis(benzoyloxy)-6-(hexyloxy)-2-[(triphenylmethoxy)methyl]oxan-3-yl benzoate
Other name (1)：
  • Hexyl 2-O,3-O,4-O-tribenzoyl-6-O-trityl-β-D-glucopyranoside
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