Chem
J-GLOBAL ID：200907014803027871   Nikkaji number：J1.193.343B

(2S,3R)-2-[(S)-Hydroxy(1-naphthyl)methyl]-3-(phenylthio)butyric acid tert-butyl ester

(2S,3R)-2-[(S)-ヒドロキシ(1-ナフチル)メチル]-3-(フェニルチオ)酪酸tert-ブチル
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： C25H28O3S
Molecular formula furigana： C25-H28-O3-S
Molecular weight： 408.560
InChI： InChI=1S/C25H28O3S/c1-17(29-19-13-6-5-7-14-19)22(24(27)28-25(2,3)4)23(26)21-16-10-12-18-11-8-9-15-20(18)21/h5-17,22-23,26H,1-4H3/t17-,22+,23-/m1/s1
InChI key： IQPPTCYKZBOJDO-MQNAVGNWSA-N
SMILES： C[C@@H](Sc1ccccc1)[C@@H]([C@H](O)c1cccc2ccccc12)C(=O)OC(C)(C)C
Systematic name  (3)：
  • (2S,3R)-2-[(S)-ヒドロキシ(1-ナフチル)メチル]-3-(フェニルチオ)酪酸tert-ブチル
  • tert-ブチル (2S,3R)-2-[(S)-ヒドロキシ(ナフタレン-1-イル)メチル]-3-(フェニルスルファニル)ブタノアート
  • tert-butyl (2S,3R)-2-[(S)-hydroxy(naphthalen-1-yl)methyl]-3-(phenylsulfanyl)butanoate
Other name (1)：
  • (2S,3R)-2-[(S)-Hydroxy(1-naphthyl)methyl]-3-(phenylthio)butyric acid tert-butyl ester
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