Chem
J-GLOBAL ID:200907024476578732   Nikkaji number:J2.338.502C

(2S)-2-(2,2-Dimethyl-3-hydroxypropionylamino)-3-phenylpropionic acid methyl ester

メチル (2S)-2-(3-ヒドロキシ-2,2-ジメチルプロパンアミド)-3-フェニルプロパノアート
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: C15H21NO4
Molecular formula furigana: C15-H21-N-O4
Molecular weight: 279.336
InChI: InChI=1S/C15H21NO4/c1-15(2,10-17)14(19)16-12(13(18)20-3)9-11-7-5-4-6-8-11/h4-8,12,17H,9-10H2,1-3H3,(H,16,19)/t12-/m0/s1
InChI key: OZLHKMUVYXUWBP-LBPRGKRZSA-N
SMILES: COC(=O)[C@H](Cc1ccccc1)NC(=O)C(C)(C)CO
Systematic name  (3):
  • (2S)-2-(2,2-ジメチル-3-ヒドロキシプロピオニルアミノ)-3-フェニルプロピオン酸メチル
  • メチル (2S)-2-(3-ヒドロキシ-2,2-ジメチルプロパンアミド)-3-フェニルプロパノアート
  • methyl (2S)-2-(3-hydroxy-2,2-dimethylpropanamido)-3-phenylpropanoate
Other name (1):
  • (2S)-2-(2,2-Dimethyl-3-hydroxypropionylamino)-3-phenylpropionic acid methyl ester
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