Pyroglutamyl-Glutamyl-Asparaginyl-Glycine
[CAS# 91856-42-7]

Identification

• Name: Pyroglutamyl-Glutamyl-Asparaginyl-Glycine
• Synonyms: (4S)-5-[[(1S)-1-(Carboxymethylcarbamoyl)-3-Hydroxy-3-Oxo-Propyl]Amino]-5-Oxo-4-[[(2S)-5-Oxopyrrolidine-2-Carbonyl]Amino]Pentanoic Acid; (4S)-5-[[(1S)-1-[(Carboxymethylamino)-Oxomethyl]-3-Hydroxy-3-Oxopropyl]Amino]-5-Oxo-4-[[Oxo-[(2S)-5-Oxo-2-Pyrrolidinyl]M
• Molecular Formula: C₁₆H₂₂N₄O₁₀
• Molecular Weight: 430.37
• CAS Registry Number: 91856-42-7
• SMILES: [C@H](C(NCC(=O)O)=O)(NC([C@@H](NC([C@H]1NC(CC1)=O)=O)CCC(=O)O)=O)CC(=O)O
• InChI: 1S/C16H22N4O10/c21-10-3-1-7(18-10)15(29)19-8(2-4-11(22)23)16(30)20-9(5-12(24)25)14(28)17-6-13(26)27/h7-9H,1-6H2,(H,17,28)(H,18,21)(H,19,29)(H,20,30)(H,22,23)(H,24,25)(H,26,27)/t7-,8-,9-/m0/s1
• InChIKey: WWBAFCZVMBCUQM-CIUDSAMLSA-N

Properties

• Density: 1.521g/cm³ (Cal.)
• Boiling point: 1121.174°C at 760 mmHg (Cal.)
• Flash point: 631.863°C (Cal.)