Boc-leucyl-seryl-threonyl-arginine-4-methylcoumaryl-7-amide
[CAS# 73554-93-5]

Identification

• Name: Boc-leucyl-seryl-threonyl-arginine-4-methylcoumaryl-7-amide
• Synonyms: Tert-Butyl N-[(1S)-1-[[(1S)-2-[[(1S,2R)-1-[[(2S)-5-Guanidino-2-[(4-Methyl-2-Oxo-Chromen-7-Yl)Amino]Pentanoyl]Carbamoyl]-2-Hydroxy-Propyl]Amino]-1-(Hydroxymethyl)-2-Oxo-Ethyl]Carbamoyl]-3-Methyl-Butyl]Carbamate; N-[(1S)-1-[[[(1S)-2-[[(1S,2R)-1-[[[(2S)-5-Guanidino-2-[(4-Methyl-2-Oxo-7-Chromenyl)Amino]-1-Oxopentyl]Amino]-Oxomethyl]-2-Hydroxypropyl]Amino]-1-(Hydroxymethyl)-2-Oxoethyl]Amino]-Oxomethyl]-3-Methylbutyl]Carbamic Acid Tert-Butyl Ester; N-[(1S)-1-[[(1S)-2-[[(1S,2R)-1-[[(2S)-5-Guanidino-2-[(2-Keto-4-Methyl-Chromen-7-Yl)Amino]Pentanoyl]Carbamoyl]-2-Hydroxy-Propyl]Amino]-2-Keto-1-Methylol-Ethyl]Carbamoyl]-3-Methyl-Butyl]Carbamic Acid Tert-Butyl Ester
• Molecular Formula: C₃₄H₅₂N₈O₁₀
• Molecular Weight: 732.83
• CAS Registry Number: 73554-93-5
• SMILES: [C@H](NC(OC(C)(C)C)=O)(CC(C)C)C(=O)N[C@H](C(=O)N[C@@H]([C@H](O)C)C(=O)NC(=O)[C@@H](NC1=CC2=C(C=C1)C(=CC(O2)=O)C)CCCN=C(N)N)CO
• InChI: 1S/C34H52N8O10/c1-17(2)13-23(40-33(50)52-34(5,6)7)29(47)39-24(16-43)30(48)41-27(19(4)44)31(49)42-28(46)22(9-8-12-37-32(35)36)38-20-10-11-21-18(3)14-26(45)51-25(21)15-20/h10-11,14-15,17,19,22-24,27,38,43-44H,8-9,12-13,16H2,1-7H3,(H,39,47)(H,40,50)(H,41,48)(H4,35,36,37)(H,42,46,49)/t19-,22+,23+,24+,27+/m1/s1
• InChIKey: KHROACPEOHQTRJ-ZDLOCFOUSA-N

Properties

• Density: 1.374g/cm³ (Cal.)