Chem
J-GLOBAL ID：200907000479246076   Nikkaji number：J771.450E

1-[(4-Methylphenyl)sulfonyl]-3α-hydroxy-3-phenyl-5β-methyl-L-proline benzyl ester

1-[(4-メチルフェニル)スルホニル]-3α-ヒドロキシ-3-フェニル-5β-メチル-L-プロリンベンジル
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： C26H27NO5S
Molecular formula furigana： C26-H27-N-O5-S
Molecular weight： 465.560
InChI： InChI=1S/C26H27NO5S/c1-19-13-15-23(16-14-19)33(30,31)27-20(2)17-26(29,22-11-7-4-8-12-22)24(27)25(28)32-18-21-9-5-3-6-10-21/h3-16,20,24,29H,17-18H2,1-2H3/t20-,24-,26+/m1/s1
InChI key： RQOIBSQIEUAFIA-ZOSUSCCZSA-N
SMILES： C[C@@H]1C[C@@](O)([C@H](N1S(=O)(=O)c1ccc(C)cc1)C(=O)OCc1ccccc1)c1ccccc1
Systematic name  (3)：
  • 1-[(4-メチルフェニル)スルホニル]-3α-ヒドロキシ-3-フェニル-5β-メチル-L-プロリンベンジル
  • ベンジル (2S,3S,5R)-3-ヒドロキシ-5-メチル-1-(4-メチルベンゼンスルホニル)-3-フェニルピロリジン-2-カルボキシラート
  • benzyl (2S,3S,5R)-3-hydroxy-5-methyl-1-(4-methylbenzenesulfonyl)-3-phenylpyrrolidine-2-carboxylate
Other name (1)：
  • 1-[(4-Methylphenyl)sulfonyl]-3α-hydroxy-3-phenyl-5β-methyl-L-proline benzyl ester
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