N(alpha)-Palmitoyl-Ornithylornithine Ethyl Ester
[CAS# 76314-99-3]

Identification

• Name: N(alpha)-Palmitoyl-Ornithylornithine Ethyl Ester
• Synonyms: (2S)-5-Amino-2-[[(2S)-5-Amino-1-Oxo-2-(1-Oxohexadecylamino)Pentyl]Amino]Pentanoic Acid Ethyl Ester Dihydrochloride; (2S)-5-Amino-2-[[(2S)-5-Amino-2-Palmitamido-Pentanoyl]Amino]Valeric Acid Ethyl Ester Dihydrochloride; Nalpha-Palmitoyl-L-Ornithyl-L-Ornithine Ethyl Ester
• Molecular Formula: C₂₈H₅₈Cl₂N₄O₄
• Molecular Weight: 585.70
• CAS Registry Number: 76314-99-3
• SMILES: [C@@H](NC(=O)CCCCCCCCCCCCCCC)(C(=O)N[C@H](C(OCC)=O)CCCN)CCCN.[H+].[H+].[Cl-].[Cl-]
• InChI: 1S/C28H56N4O4.2ClH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-21-26(33)31-24(19-17-22-29)27(34)32-25(20-18-23-30)28(35)36-4-2;;/h24-25H,3-23,29-30H2,1-2H3,(H,31,33)(H,32,34);2*1H/t24-,25-;;/m0../s1
• InChIKey: XWQVPLRFEWUMQM-LXTBHBSOSA-N

Properties

• Boiling point: 692°C at 760 mmHg (Cal.)
• Flash point: 372.3°C (Cal.)