Chem
J-GLOBAL ID：200907035132799251   Nikkaji number：J2.494.352F

p-Tolyl 2-O,3-O,4-O,6-O-tetrabenzoyl-1-thio-α-D-mannopyranoside

p-トリル2-O,3-O,4-O,6-O-テトラベンゾイル-1-チオ-α-D-マンノピラノシド
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： C41H34O9S
Molecular formula furigana： C41-H34-O9-S
Molecular weight： 702.770
InChI： InChI=1S/C41H34O9S/c1-27-22-24-32(25-23-27)51-41-36(50-40(45)31-20-12-5-13-21-31)35(49-39(44)30-18-10-4-11-19-30)34(48-38(43)29-16-8-3-9-17-29)33(47-41)26-46-37(42)28-14-6-2-7-15-28/h2-25,33-36,41H,26H2,1H3/t33-,34-,35+,36+,41-/m1/s1
InChI key： QZUOKKMGLFXBME-KBHDIFKJSA-N
SMILES： Cc1ccc(S[C@H]2O[C@H](COC(=O)c3ccccc3)[C@@H](OC(=O)c3ccccc3)[C@H](OC(=O)c3ccccc3)[C@@H]2OC(=O)c2ccccc2)cc1
Systematic name  (4)：
  • p-トリル2-O,3-O,4-O,6-O-テトラベンゾイル-1-チオ-α-D-マンノピラノシド
  • 1-S-(4-メチルフェニル)-2-O,3-O,4-O,6-O-テトラベンゾイル-1-チオ-α-D-マンノピラノース
  • [(2R,3R,4S,5S,6R)-3,4,5-トリス(ベンゾイルオキシ)-6-[(4-メチルフェニル)スルファニル]オキサン-2-イル]メチル ベンゾアート
  • [(2R,3R,4S,5S,6R)-3,4,5-tris(benzoyloxy)-6-[(4-methylphenyl)sulfanyl]oxan-2-yl]methyl benzoate
Other name (2)：
  • p-Tolyl 2-O,3-O,4-O,6-O-tetrabenzoyl-1-thio-α-D-mannopyranoside
  • 1-S-(4-Methylphenyl)-2-O,3-O,4-O,6-O-tetrabenzoyl-1-thio-α-D-mannopyranose
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