N-(3-Carboxypropanoyl)-L-alanyl-L-alanyl-L-prolyl-N-(4-nitrophenyl)-L-leucinamide
[CAS# 70968-04-6]

Identification

• Name: N-(3-Carboxypropanoyl)-L-alanyl-L-alanyl-L-prolyl-N-(4-nitrophenyl)-L-leucinamide
• Synonyms: L-Leucinamide, N-(3-carboxy-1-oxopropyl)-L-alanyl-L-alanyl-L-prolyl-N-(4-nitrophenyl)-; N-(3-Carboxypropanoyl)-L-alanyl-L-alanyl-L-prolyl-N-(4-nitrophenyl)-L-leucinamid; N-(3-Carboxypropanoyl)-L-alanyl-L-alanyl-L-prolyl-N-(4-nitrophenyl)-L-leucinamide
• Molecular Formula: C₂₇H₃₈N₆O₉
• Molecular Weight: 590.63
• CAS Registry Number: 70968-04-6
• SMILES: C[C@@H](C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(=O)Nc2ccc(cc2)[N+](=O)[O-])NC(=O)CCC(=O)O
• InChI: 1S/C27H38N6O9/c1-15(2)14-20(25(38)30-18-7-9-19(10-8-18)33(41)42)31-26(39)21-6-5-13-32(21)27(40)17(4)29-24(37)16(3)28-22(34)11-12-23(35)36/h7-10,15-17,20-21H,5-6,11-14H2,1-4H3,(H,28,34)(H,29,37)(H,30,38)(H,31,39)(H,35,36)/t16-,17-,20-,21-/m0/s1
• InChIKey: PTHRPHGMGFMCSS-USNOLKROSA-N
• Protein Sequence: Suc-Ala-Ala-Pro-Leu-pNA

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 1003.8±65.0°C at 760 mmHg (Cal.)
• Flash point: 560.9±34.3°C (Cal.)