Chem
J-GLOBAL ID:200907049360487619   Nikkaji number:J2.338.493K

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

(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: C18H27NO4
Molecular formula furigana: C18-H27-N-O4
Molecular weight: 321.417
InChI: InChI=1S/C18H27NO4/c1-17(2,3)23-15(21)14(11-13-9-7-6-8-10-13)19-16(22)18(4,5)12-20/h6-10,14,20H,11-12H2,1-5H3,(H,19,22)/t14-/m0/s1
InChI key: JRYVQKNWSFINGB-AWEZNQCLSA-N
SMILES: CC(C)(C)OC(=O)[C@H](Cc1ccccc1)NC(=O)C(C)(C)CO
Systematic name  (4):
  • (2S)-2-(3-ヒドロキシ-2,2-ジメチルプロピオニルアミノ)-3-フェニルプロピオン酸tert-ブチル
  • (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tert-ブチル
  • tert-ブチル (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
  • tert-butyl (2S)-2-(3-hydroxy-2,2-dimethylpropanamido)-3-phenylpropanoate
Other name (2):
  • (2S)-2-(3-Hydroxy-2,2-dimethylpropionylamino)-3-phenylpropionic acid tert-butyl ester
  • (2S)-2-(2,2-Dimethyl-3-hydroxypropionylamino)-3-phenylpropionic acid tert-butyl ester
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