Chem
J-GLOBAL ID：200907065088537470   Nikkaji number：J404.629C

Sch-39370

Sch-39370
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： C22H26N2O6
Molecular formula furigana： C22-H26-N2-O6
Molecular weight： 414.458
InChI： InChI=1S/C22H26N2O6/c25-19(22(29)30)14-23-20(26)18(13-16-9-5-2-6-10-16)24-17(21(27)28)12-11-15-7-3-1-4-8-15/h1-10,17-19,24-25H,11-14H2,(H,23,26)(H,27,28)(H,29,30)/t17-,18-,19-/m0/s1
InChI key： QAQRHURCJWHRJU-FHWLQOOXSA-N
SMILES： O[C@@H](CNC(=O)[C@H](Cc1ccccc1)N[C@@H](CCc1ccccc1)C(=O)O)C(=O)O
Systematic name  (3)：
  • (S)-N-[N-[(S)-1-カルボキシ-3-フェニルプロピル]-L-フェニルアラニル]-2-ヒドロキシ-β-アラニン
  • (2S)-2-{[(1S)-1-{[(2S)-2-カルボキシ-2-ヒドロキシエチル]カルバモイル}-2-フェニルエチル]アミノ}-4-フェニルブタン酸
  • (2S)-2-{[(1S)-1-{[(2S)-2-carboxy-2-hydroxyethyl]carbamoyl}-2-phenylethyl]amino}-4-phenylbutanoic acid
Other name (3)：
  • SCH-39370
  • Sch-39370
  • (S)-N-[N-[(S)-1-Carboxy-3-phenylpropyl]-L-phenylalanyl]-2-hydroxy-β-alanine
CAS registry number： 115406-23-0
Application (2)：
enzyme activator ,  enzyme inhibitor
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