5-Oxo-L-prolyl-L-histidyl-L-prolyl-Glycine
[CAS# 85344-77-0]

Identification

• Name: 5-Oxo-L-prolyl-L-histidyl-L-prolyl-Glycine
• Synonyms: 2-[[[(2S)-1-[(2S)-3-(3H-Imidazol-4-Yl)-1-Oxo-2-[[Oxo-[(2S)-5-Oxo-2-Pyrrolidinyl]Methyl]Amino]Propyl]-2-Pyrrolidinyl]-Oxomethyl]Amino]Acetic Acid; 2-[[(2S)-1-[(2S)-3-(3H-Imidazol-4-Yl)-2-(Pyroglutamoylamino)Propanoyl]Pyrrolidine-2-Carbonyl]Amino]Acetic Acid; 2-[[(2S)-1-[(2S)-3-(3H-Imidazol-4-Yl)-2-[[(2S)-5-Oxopyrrolidin-2-Yl]Carbonylamino]Propanoyl]Pyrrolidin-2-Yl]Carbonylamino]Ethanoic Acid
• Molecular Formula: C₁₈H₂₄N₆O₆
• Molecular Weight: 420.42
• CAS Registry Number: 85344-77-0
• SMILES: [C@H](C(N1[C@H](C(NCC(=O)O)=O)CCC1)=O)(NC([C@H]2NC(=O)CC2)=O)CC3=CN=C[NH]3
• InChI: 1S/C18H24N6O6/c25-14-4-3-11(22-14)16(28)23-12(6-10-7-19-9-21-10)18(30)24-5-1-2-13(24)17(29)20-8-15(26)27/h7,9,11-13H,1-6,8H2,(H,19,21)(H,20,29)(H,22,25)(H,23,28)(H,26,27)/t11-,12-,13-/m0/s1
• InChIKey: CSVCLHYFVGHUCM-AVGNSLFASA-N

Properties

• Density: 1.462g/cm³ (Cal.)
• Boiling point: 1069.529°C at 760 mmHg (Cal.)
• Flash point: 600.629°C (Cal.)