(2S)-N-[(2S)-6-Amino-2-[[(2S)-1-[(2S)-2-Amino-5-(Diaminomethylideneamino)Pentanoyl]Pyrrolidine-2-Carbonyl]Amino]Hexanoyl]-1-Dodecylpyrrolidine-2-Carboxamide
[CAS# 111422-31-2]

Identification

• Name: (2S)-N-[(2S)-6-Amino-2-[[(2S)-1-[(2S)-2-Amino-5-(Diaminomethylideneamino)Pentanoyl]Pyrrolidine-2-Carbonyl]Amino]Hexanoyl]-1-Dodecylpyrrolidine-2-Carboxamide
• Synonyms: (2S)-N-[(2S)-6-Amino-2-[[(2S)-1-[(2S)-2-Amino-5-Guanidino-Pentanoyl]Pyrrolidine-2-Carbonyl]Amino]Hexanoyl]-1-Dodecyl-Pyrrolidine-2-Carboxamide; (2S)-N-[(2S)-6-Amino-2-[[[(2S)-1-[(2S)-2-Amino-5-Guanidino-1-Oxopentyl]-2-Pyrrolidinyl]-Oxomethyl]Amino]-1-Oxohexyl]-1-Dodecyl-2-Pyrrolidinecarboxamide; (2S)-N-[(2S)-6-Amino-2-[[(2S)-1-[(2S)-2-Amino-5-Guanidino-Pentanoyl]Pyrrolidine-2-Carbonyl]Amino]Hexanoyl]-1-Lauryl-Pyrrolidine-2-Carboxamide
• Molecular Formula: C₃₄H₆₅N₉O₄
• Molecular Weight: 663.95
• CAS Registry Number: 111422-31-2
• SMILES: [C@@H]1(N(CCC1)CCCCCCCCCCCC)C(=O)NC(=O)[C@@H](NC(=O)[C@H]2N(CCC2)C(=O)[C@@H](N)CCCN=C(N)N)CCCCN
• InChI: 1S/C34H65N9O4/c1-2-3-4-5-6-7-8-9-10-13-23-42-24-15-19-28(42)31(45)41-30(44)27(18-11-12-21-35)40-32(46)29-20-16-25-43(29)33(47)26(36)17-14-22-39-34(37)38/h26-29H,2-25,35-36H2,1H3,(H,40,46)(H4,37,38,39)(H,41,44,45)/t26-,27-,28-,29-/m0/s1
• InChIKey: DQGMTLZKLMCVRL-DZUOILHNSA-N

Properties

• Density: 1.246g/cm³ (Cal.)