Pyroglutamyl-glutamyl-glycyl-seryl-asparagine
[CAS# 129276-54-6]

Identification

• Name: Pyroglutamyl-glutamyl-glycyl-seryl-asparagine
• Synonyms: (4S)-5-[[2-[[(1S)-2-[[(1S)-3-Amino-1-Carboxy-3-Oxopropyl]Amino]-1-(Hydroxymethyl)-2-Oxoethyl]Amino]-2-Oxoethyl]Amino]-5-Oxo-4-[[Oxo-[(2S)-5-Oxo-2-Pyrrolidinyl]Methyl]Amino]Pentanoic Acid; (4S)-5-[[2-[[(1S)-2-[[(1S)-3-Amino-1-Carboxy-3-Keto-Propyl]Amino]-2-Keto-1-Methylol-Ethyl]Amino]-2-Keto-Ethyl]Amino]-5-Keto-4-(Pyroglutamoylamino)Valeric Acid; (4S)-5-[[2-[[(1S)-2-[[(1S)-3-Amino-1-Carboxy-3-Oxo-Propyl]Amino]-1-(Hydroxymethyl)-2-Oxo-Ethyl]Amino]-2-Oxo-Ethyl]Amino]-5-Oxo-4-[[(2S)-5-Oxopyrrolidine-2-Carbonyl]Amino]Pentanoic Acid
• Molecular Formula: C₁₉H₂₈N₆O₁₁
• Molecular Weight: 516.46
• CAS Registry Number: 129276-54-6
• SMILES: [C@H](C(=O)O)(NC([C@@H](NC(CNC([C@@H](NC([C@H]1NC(CC1)=O)=O)CCC(=O)O)=O)=O)CO)=O)CC(=O)N
• InChI: 1S/C19H28N6O11/c20-12(27)5-10(19(35)36)25-18(34)11(7-26)23-14(29)6-21-16(32)8(2-4-15(30)31)24-17(33)9-1-3-13(28)22-9/h8-11,26H,1-7H2,(H2,20,27)(H,21,32)(H,22,28)(H,23,29)(H,24,33)(H,25,34)(H,30,31)(H,35,36)/t8-,9-,10-,11-/m0/s1
• InChIKey: LZAPZYPGMQKGDR-NAKRPEOUSA-N

Properties

• Density: 1.508g/cm³ (Cal.)
• Boiling point: 1303.204°C at 760 mmHg (Cal.)
• Flash point: 741.951°C (Cal.)