(2S)-2-[[(2S)-2-[[2-[[2-[4-[(4-Hydroxyphenyl)Methyl]-2-Methyl-5-Oxoimidazolidin-1-Yl]Acetyl]Amino]Acetyl]Amino]-3-Phenylpropanoyl]Amino]-4-Methylpentanoic Acid
[CAS# 76157-62-5]

Identification

• Name: (2S)-2-[[(2S)-2-[[2-[[2-[4-[(4-Hydroxyphenyl)Methyl]-2-Methyl-5-Oxoimidazolidin-1-Yl]Acetyl]Amino]Acetyl]Amino]-3-Phenylpropanoyl]Amino]-4-Methylpentanoic Acid
• Synonyms: (2S)-2-[[(2S)-2-[[2-[[2-[4-[(4-Hydroxyphenyl)Methyl]-2-Methyl-5-Oxo-Imidazolidin-1-Yl]Acetyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoic Acid; (2S)-2-[[(2S)-2-[[2-[[2-[4-[(4-Hydroxyphenyl)Methyl]-2-Methyl-5-Oxo-1-Imidazolidinyl]-1-Oxoethyl]Amino]-1-Oxoethyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-4-Methylpentanoic Acid; (2S)-2-[[(2S)-2-[[2-[[2-[4-(4-Hydroxybenzyl)-5-Keto-2-Methyl-Imidazolidin-1-Yl]Acetyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Valeric Acid
• Molecular Formula: C₃₀H₃₉N₅O₇
• Molecular Weight: 581.67
• CAS Registry Number: 76157-62-5
• SMILES: [C@@H](NC(=O)CNC(=O)CN1C(=O)C(NC1C)CC2=CC=C(O)C=C2)(C(=O)N[C@H](C(=O)O)CC(C)C)CC3=CC=CC=C3
• InChI: 1S/C30H39N5O7/c1-18(2)13-25(30(41)42)34-28(39)23(14-20-7-5-4-6-8-20)33-26(37)16-31-27(38)17-35-19(3)32-24(29(35)40)15-21-9-11-22(36)12-10-21/h4-12,18-19,23-25,32,36H,13-17H2,1-3H3,(H,31,38)(H,33,37)(H,34,39)(H,41,42)/t19?,23-,24?,25-/m0/s1
• InChIKey: FFRVEERKIAQFMO-AXOKTRKHSA-N

Properties

• Density: 1.258g/cm³ (Cal.)
• Boiling point: 971.063°C at 760 mmHg (Cal.)
• Flash point: 541.08°C (Cal.)