Chem
J-GLOBAL ID：200907068285444849
Nikkaji number：J1.911.053B
1-O,2-O-Isopropylidene-3-O-benzyl-5-O-mesyl-6-O-benzoyl(6-13C)-β-L-altrofuranose
1-O,2-O-イソプロピリデン-3-O-ベンジル-5-O-メシル-6-O-ベンゾイル(6-13C)-β-L-アルトロフラノース
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
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
Molecular formula： C23[13C]H28O9S
Molecular formula furigana： C24-H28-O9-S
Molecular weight： 493.530
InChI：
InChI=1S/C24H28O9S/c1-24(2)31-21-20(28-14-16-10-6-4-7-11-16)19(30-23(21)32-24)18(33-34(3,26)27)15-29-22(25)17-12-8-5-9-13-17/h4-13,18-21,23H,14-15H2,1-3H3/t18-,19-,20-,21+,23+/m0/s1/i15+1
InChI key：
KWTHKPCLCDSWJM-YOJHZPJYSA-N
SMILES：
CC1(C)O[C@H]2O[C@@H]([C@H]([13CH2]OC(=O)c3ccccc3)OS(=O)(=O)C)[C@H](OCc3ccccc3)[C@H]2O1
Systematic name (3)：
- 1-O,2-O-イソプロピリデン-3-O-ベンジル-5-O-メシル-6-O-ベンゾイル(6-13C)-β-L-アルトロフラノース
- (2R)-2-[(3aR,5R,6S,6aR)-6-(ベンジルオキシ)-2,2-ジメチル-テトラヒドロ-2H-フロ[2,3-d][1,3]ジオキソール-5-イル]-2-(メタンスルホニルオキシ)(1-13C)エチル ベンゾアート
- (2R)-2-[(3aR,5R,6S,6aR)-6-(benzyloxy)-2,2-dimethyl-tetrahydro-2H-furo[2,3-d][1,3]dioxol-5-yl]-2-(methanesulfonyloxy)(1-13C)ethyl benzoate
- 1-O,2-O-Isopropylidene-3-O-benzyl-5-O-mesyl-6-O-benzoyl(6-13C)-β-L-altrofuranose
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