Chem
J-GLOBAL ID：201707020275783882   Nikkaji number：J3.575.167J

3-O-[4-O,6-O-(Benzylidene)-α-D-mannopyranosyl]-2-O-acetyl-4-O,6-O-(benzylidene)-1-deoxy-1-(isopropylthio)-β-D-galactopyranose

3-O-[4-O,6-O-(ベンジリデン)-α-D-マンノピラノシル]-2-O-アセチル-4-O,6-O-(ベンジリデン)-1-デオキシ-1-(イソプロピルチオ)-β-D-ガラクトピラノース
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： C31H38O11S
Molecular formula furigana： C31-H38-O11-S
Molecular weight： 618.690
InChI： InChI=1S/C31H38O11S/c1-16(2)43-31-27(37-17(3)32)26(25-21(39-31)15-36-29(41-25)19-12-8-5-9-13-19)42-30-23(34)22(33)24-20(38-30)14-35-28(40-24)18-10-6-4-7-11-18/h4-13,16,20-31,33-34H,14-15H2,1-3H3/t20-,21-,22-,23+,24-,25+,26+,27-,28?,29?,30-,31+/m1/s1
InChI key： GGZANCQCFMGSMD-LNOKQAOUSA-N
SMILES： CC(C)S[C@@H]1O[C@@H]2COC(O[C@@H]2[C@H](O[C@H]2O[C@@H]3COC(O[C@H]3[C@H](O)[C@@H]2O)c2ccccc2)[C@H]1OC(=O)C)c1ccccc1
Systematic name  (3)：
  • 3-O-[4-O,6-O-(ベンジリデン)-α-D-マンノピラノシル]-2-O-アセチル-4-O,6-O-(ベンジリデン)-1-デオキシ-1-(イソプロピルチオ)-β-D-ガラクトピラノース
  • (4aR,6S,7R,8S,8aS)-8-{[(4aR,6R,7S,8R,8aS)-7,8-ジヒドロキシ-2-フェニル-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-6-イル]オキシ}-2-フェニル-6-(プロパン-2-イルスルファニル)-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-7-イル アセタート
  • (4aR,6S,7R,8S,8aS)-8-{[(4aR,6R,7S,8R,8aS)-7,8-dihydroxy-2-phenyl-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-6-yl]oxy}-2-phenyl-6-(propan-2-ylsulfanyl)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl acetate
Other name (1)：
  • 3-O-[4-O,6-O-(Benzylidene)-α-D-mannopyranosyl]-2-O-acetyl-4-O,6-O-(benzylidene)-1-deoxy-1-(isopropylthio)-β-D-galactopyranose
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