2-Hydroxy-4-Carboxybutyrylhistidylprolinamide
[CAS# 83437-32-5]

Identification

• Name: 2-Hydroxy-4-Carboxybutyrylhistidylprolinamide
• Synonyms: 5-[[(1S)-2-[(2S)-2-Carbamoylpyrrolidin-1-Yl]-1-(3H-Imidazol-4-Ylmethyl)-2-Oxo-Ethyl]Amino]-4-Hydroxy-5-Oxo-Pentanoic Acid; 5-[[(1S)-2-[(2S)-2-Carbamoyl-1-Pyrrolidinyl]-1-(3H-Imidazol-4-Ylmethyl)-2-Oxoethyl]Amino]-4-Hydroxy-5-Oxopentanoic Acid; 5-[[(1S)-2-[(2S)-2-Carbamoylpyrrolidin-1-Yl]-1-(3H-Imidazol-4-Ylmethyl)-2-Keto-Ethyl]Amino]-4-Hydroxy-5-Keto-Valeric Acid
• Molecular Formula: C₁₆H₂₃N₅O₆
• Molecular Weight: 381.39
• CAS Registry Number: 83437-32-5
• SMILES: [C@H]1(C(=O)N)N(CCC1)C([C@@H](NC(C(CCC(=O)O)O)=O)CC2=CN=C[NH]2)=O
• InChI: 1S/C16H23N5O6/c17-14(25)11-2-1-5-21(11)16(27)10(6-9-7-18-8-19-9)20-15(26)12(22)3-4-13(23)24/h7-8,10-12,22H,1-6H2,(H2,17,25)(H,18,19)(H,20,26)(H,23,24)/t10-,11-,12?/m0/s1
• InChIKey: QTSAHVCUJWDFEQ-NDQFZYFBSA-N

Properties

• Density: 1.469g/cm³ (Cal.)
• Boiling point: 968.765°C at 760 mmHg (Cal.)
• Flash point: 539.689°C (Cal.)