gamma-(Pyroglutamyl-Glutamyl-Asparaginyl-Glycine)Amide
[CAS# 91856-43-8]

Identification

• Name: gamma-(Pyroglutamyl-Glutamyl-Asparaginyl-Glycine)Amide
• Synonyms: (3S)-3-[[(2S)-5-Amino-5-Oxo-2-[[(2S)-5-Oxopyrrolidine-2-Carbonyl]Amino]Pentanoyl]Amino]-4-(Carboxymethylamino)-4-Oxo-Butanoic Acid; (3S)-3-[[(2S)-5-Amino-1,5-Dioxo-2-[[Oxo-[(2S)-5-Oxo-2-Pyrrolidinyl]Methyl]Amino]Pentyl]Amino]-4-(Carboxymethylamino)-4-Oxobu
• Molecular Formula: C₁₆H₂₃N₅O₉
• Molecular Weight: 429.39
• CAS Registry Number: 91856-43-8
• SMILES: [C@H](C(NCC(=O)O)=O)(NC([C@@H](NC([C@H]1NC(CC1)=O)=O)CCC(=O)N)=O)CC(=O)O
• InChI: 1S/C16H23N5O9/c17-10(22)3-1-8(20-15(29)7-2-4-11(23)19-7)16(30)21-9(5-12(24)25)14(28)18-6-13(26)27/h7-9H,1-6H2,(H2,17,22)(H,18,28)(H,19,23)(H,20,29)(H,21,30)(H,24,25)(H,26,27)/t7-,8-,9-/m0/s1
• InChIKey: PYLKSIZIVWBTDB-CIUDSAMLSA-N

Properties

• Density: 1.485g/cm³ (Cal.)
• Boiling point: 1156.05°C at 760 mmHg (Cal.)
• Flash point: 652.955°C (Cal.)