Tert-Butyl N-[2-[[(1S)-4-Guanidino-1-[[(1S)-4-Guanidino-1-[(4-Methyl-2-Oxo-Chromen-7-Yl)Carbamoyl]Butyl]Carbamoyl]Butyl]Amino]-2-Oxo-Ethyl]Carbamate
[CAS# 113866-14-1]

Identification

• Name: Tert-Butyl N-[2-[[(1S)-4-Guanidino-1-[[(1S)-4-Guanidino-1-[(4-Methyl-2-Oxo-Chromen-7-Yl)Carbamoyl]Butyl]Carbamoyl]Butyl]Amino]-2-Oxo-Ethyl]Carbamate
• Synonyms: Boc-GRR-AMC
• Molecular Formula: C₂₉H₄₄N₁₀O₇
• Molecular Weight: 644.72
• CAS Registry Number: 113866-14-1
• SMILES: Cc1cc(=O)oc2c1ccc(c2)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCNC(=N)N)NC(=O)CNC(=O)OC(C)(C)C
• InChI: 1S/C29H44N10O7/c1-16-13-23(41)45-21-14-17(9-10-18(16)21)37-24(42)20(8-6-12-35-27(32)33)39-25(43)19(7-5-11-34-26(30)31)38-22(40)15-36-28(44)46-29(2,3)4/h9-10,13-14,19-20H,5-8,11-12,15H2,1-4H3,(H,36,44)(H,37,42)(H,38,40)(H,39,43)(H4,30,31,34)(H4,32,33,35)/t19-,20-/m0/s1
• InChIKey: KAOILQBHONVZOC-PMACEKPBSA-N

Properties

• Density: 1.408g/cm³ (Cal.)
• Refractive index: 1.635 (Cal.)