(2S)-1-[2-[[(2S)-2-(Benzoylamino)-3-Phenylpropanoyl]Amino]Acetyl]Pyrrolidine-2-Carboxylic Acid
[CAS# 74075-25-5]

Identification

• Name: (2S)-1-[2-[[(2S)-2-(Benzoylamino)-3-Phenylpropanoyl]Amino]Acetyl]Pyrrolidine-2-Carboxylic Acid
• Synonyms: (2S)-1-[2-[[(2S)-2-(Benzoylamino)-3-Phenyl-Propanoyl]Amino]Acetyl]Pyrrolidine-2-Carboxylic Acid; (2S)-1-[1-Oxo-2-[[(2S)-1-Oxo-2-[(Oxo-Phenylmethyl)Amino]-3-Phenylpropyl]Amino]Ethyl]-2-Pyrrolidinecarboxylic Acid; (2S)-1-[2-[[(2S)-2-(Benzoylamino)-3-Phenyl-Propanoyl]Amino]Acetyl]Proline
• Molecular Formula: C₂₃H₂₅N₃O₅
• Molecular Weight: 423.47
• CAS Registry Number: 74075-25-5
• SMILES: [C@H]1(C(=O)O)N(CCC1)C(CNC([C@@H](NC(C2=CC=CC=C2)=O)CC3=CC=CC=C3)=O)=O
• InChI: 1S/C23H25N3O5/c27-20(26-13-7-12-19(26)23(30)31)15-24-22(29)18(14-16-8-3-1-4-9-16)25-21(28)17-10-5-2-6-11-17/h1-6,8-11,18-19H,7,12-15H2,(H,24,29)(H,25,28)(H,30,31)/t18-,19-/m0/s1
• InChIKey: UVLMBMAKGAUBDU-OALUTQOASA-N

Properties

• Density: 1.305g/cm³ (Cal.)
• Boiling point: 814.876°C at 760 mmHg (Cal.)
• Flash point: 446.621°C (Cal.)