N-[(Phenylmethoxy)carbonyl]-D-phenylalanyl-L-phenylalanyl-Glycine
[CAS# 75539-79-6]

Identification

• Name: N-[(Phenylmethoxy)carbonyl]-D-phenylalanyl-L-phenylalanyl-Glycine
• Synonyms: 2-[[(2S)-1-Oxo-2-[[(2R)-1-Oxo-2-[[Oxo-(Phenylmethoxy)Methyl]Amino]-3-Phenylpropyl]Amino]-3-Phenylpropyl]Amino]Acetic Acid; 2-[[(2S)-2-[[(2R)-2-(Benzyloxycarbonylamino)-3-Phenyl-Propanoyl]Amino]-3-Phenyl-Propanoyl]Amino]Acetic Acid; 2-[[(2S)-3-Phenyl-2-[[(2R)-3-Phenyl-2-(Phenylmethoxycarbonylamino)Propanoyl]Amino]Propanoyl]Amino]Ethanoic Acid
• Molecular Formula: C₂₈H₂₉N₃O₆
• Molecular Weight: 503.55
• CAS Registry Number: 75539-79-6
• SMILES: [C@H](NC(OCC1=CC=CC=C1)=O)(C(=O)N[C@H](C(=O)NCC(=O)O)CC2=CC=CC=C2)CC3=CC=CC=C3
• InChI: 1S/C28H29N3O6/c32-25(33)18-29-26(34)23(16-20-10-4-1-5-11-20)30-27(35)24(17-21-12-6-2-7-13-21)31-28(36)37-19-22-14-8-3-9-15-22/h1-15,23-24H,16-19H2,(H,29,34)(H,30,35)(H,31,36)(H,32,33)/t23-,24+/m0/s1
• InChIKey: ZSOSVHOISBSKID-BJKOFHAPSA-N
• Protein Sequence: Z-D-Phe-Phe-Gly-OH

Properties

• Density: 1.274g/cm³ (Cal.)
• Boiling point: 861.201°C at 760 mmHg (Cal.)
• Flash point: 474.637°C (Cal.)