(2S)-N-[(2S)-2-[[(2S)-2-Dimethylamino-3-Methylbutanoyl]Amino]-3-Methylbutanoyl]-1-[(2S)-3-Methyl-2-Methylaminobutanoyl]-N-[(2S)-1-(Phenylmethyl)Pyrrolidine-2-Carbonyl]Pyrrolidine-2-Carboxamide
[CAS# 159776-69-9]

Identification

• Name: (2S)-N-[(2S)-2-[[(2S)-2-Dimethylamino-3-Methylbutanoyl]Amino]-3-Methylbutanoyl]-1-[(2S)-3-Methyl-2-Methylaminobutanoyl]-N-[(2S)-1-(Phenylmethyl)Pyrrolidine-2-Carbonyl]Pyrrolidine-2-Carboxamide
• Synonyms: (2S)-N-[(2S)-2-[[(2S)-2-Dimethylamino-3-Methyl-Butanoyl]Amino]-3-Methyl-Butanoyl]-1-[(2S)-3-Methyl-2-Methylamino-Butanoyl]-N-[(2S)-1-(Phenylmethyl)Pyrrolidine-2-Carbonyl]Pyrrolidine-2-Carboxamide; (2S)-N-[(2S)-2-[[(2S)-2-Dimethylamino-3-Methyl-1-Oxobutyl]Amino]-3-Methyl-1-Oxobutyl]-1-[(2S)-3-Methyl-2-Methylamino-1-Oxobutyl]-N-[Oxo-[(2S)-1-(Phenylmethyl)-2-Pyrrolidinyl]Methyl]-2-Pyrrolidinecarboxamide; (2S)-N-[(2S)-1-(Benzyl)Pyrrolidine-2-Carbonyl]-N-[(2S)-2-[[(2S)-2-Dimethylamino-3-Methyl-Butanoyl]Amino]-3-Methyl-Butanoyl]-1-[(2S)-3-Methyl-2-Methylamino-Butanoyl]Pyrrolidine-2-Carboxamide
• Molecular Formula: C₃₅H₅₆N₆O₅
• Molecular Weight: 640.86
• CAS Registry Number: 159776-69-9
• SMILES: [C@@H]1(N(C(=O)[C@@H](NC)C(C)C)CCC1)C(=O)N(C(=O)[C@H]2N(CCC2)CC3=CC=CC=C3)C(=O)[C@@H](NC(=O)[C@@H](N(C)C)C(C)C)C(C)C
• InChI: 1S/C35H56N6O5/c1-22(2)28(36-7)34(45)40-20-14-18-27(40)33(44)41(32(43)26-17-13-19-39(26)21-25-15-11-10-12-16-25)35(46)29(23(3)4)37-31(42)30(24(5)6)38(8)9/h10-12,15-16,22-24,26-30,36H,13-14,17-21H2,1-9H3,(H,37,42)/t26-,27-,28-,29-,30-/m0/s1
• InChIKey: LSIZJZZMXCWHBR-IIZANFQQSA-N

Properties

• Density: 1.139g/cm³ (Cal.)