Pyroglutamyl-3-Methylhistidyl-Glycine
[CAS# 82780-18-5]

Identification

• Name: Pyroglutamyl-3-Methylhistidyl-Glycine
• Synonyms: 2-[[(2S)-3-(3-Methyl-4-Imidazolyl)-1-Oxo-2-[[Oxo-[(2S)-5-Oxo-2-Pyrrolidinyl]Methyl]Amino]Propyl]Amino]Acetic Acid; 2-[[(2S)-3-(3-Methylimidazol-4-Yl)-2-(Pyroglutamoylamino)Propanoyl]Amino]Acetic Acid; 2-[[(2S)-3-(3-Methylimidazol-4-Yl)-2-[[(2S)-5-Oxopyrrolidin-2-Yl]Carbonylamino]Propanoyl]Amino]Ethanoic Acid
• Molecular Formula: C₁₄H₁₉N₅O₅
• Molecular Weight: 337.33
• CAS Registry Number: 82780-18-5
• SMILES: [C@H](C(NCC(=O)O)=O)(NC([C@H]1NC(CC1)=O)=O)CC2=CN=C[N]2C
• InChI: 1S/C14H19N5O5/c1-19-7-15-5-8(19)4-10(13(23)16-6-12(21)22)18-14(24)9-2-3-11(20)17-9/h5,7,9-10H,2-4,6H2,1H3,(H,16,23)(H,17,20)(H,18,24)(H,21,22)/t9-,10-/m0/s1
• InChIKey: GBCIQPUAKFIRCP-UWVGGRQHSA-N

Properties

• Density: 1.561g/cm³ (Cal.)
• Boiling point: 946.237°C at 760 mmHg (Cal.)
• Flash point: 526.065°C (Cal.)