1-(2,4-Dinitrophenyl)-L-Prolyl-L-Leucylglycyl-L-Isoleucyl-L-Alanylglycyl-L-Argininamide
[CAS# 60643-92-7]

Identification

• Name: 1-(2,4-Dinitrophenyl)-L-Prolyl-L-Leucylglycyl-L-Isoleucyl-L-Alanylglycyl-L-Argininamide
• Synonyms: (2S)-N-[(1S)-1-[[2-[[(1S,2S)-1-[[(1S)-2-[[2-[[(1S)-1-Carbamoyl-4-Guanidino-Butyl]Amino]-2-Oxo-Ethyl]Amino]-1-Methyl-2-Oxo-Ethyl]Carbamoyl]-2-Methyl-Butyl]Amino]-2-Oxo-Ethyl]Carbamoyl]-3-Methyl-Butyl]-1-(2,4-Dinitrophenyl)Pyrrolidine-2-Carboxamide; (2S)-N-[(1S)-1-[[[2-[[(1S,2S)-1-[[[(1S)-2-[[2-[[(1S)-1-Carbamoyl-4-Guanidinobutyl]Amino]-2-Oxoethyl]Amino]-1-Methyl-2-Oxoethyl]Amino]-Oxomethyl]-2-Methylbutyl]Amino]-2-Oxoethyl]Amino]-Oxomethyl]-3-Methylbutyl]-1-(2,4-Dinitrophenyl)-2-Pyrrolidinecarboxamide; (2S)-N-[(1S)-1-[[2-[[(1S,2S)-1-[[(1S)-2-[[2-[[(1S)-1-Carbamoyl-4-Guanidino-Butyl]Amino]-2-Keto-Ethyl]Amino]-2-Keto-1-Methyl-Ethyl]Carbamoyl]-2-Methyl-Butyl]Amino]-2-Keto-Ethyl]Carbamoyl]-3-Methyl-Butyl]-1-(2,4-Dinitrophenyl)Pyrrolidine-2-Carboxamide
• Molecular Formula: C₃₆H₅₇N₁₃O₁₁
• Molecular Weight: 847.93
• CAS Registry Number: 60643-92-7
• EINECS: 262-346-0
• SMILES: [C@@H]1(N(CCC1)C2=C([N+]([O-])=O)C=C([N+]([O-])=O)C=C2)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H]([C@H](CC)C)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CCCN=C(N)N)C(=O)N
• InChI: 1S/C36H57N13O11/c1-6-20(4)30(35(56)43-21(5)32(53)41-17-28(50)44-23(31(37)52)9-7-13-40-36(38)39)46-29(51)18-42-33(54)24(15-19(2)3)45-34(55)26-10-8-14-47(26)25-12-11-22(48(57)58)16-27(25)49(59)60/h11-12,16,19-21,23-24,26,30H,6-10,13-15,17-18H2,1-5H3,(H2,37,52)(H,41,53)(H,42,54)(H,43,56)(H,44,50)(H,45,55)(H,46,51)(H4,38,39,40)/t20-,21-,23-,24-,26-,30-/m0/s1
• InChIKey: KGSKQRPJFBFFBW-LVSKWPNFSA-N

Properties

• Density: 1.477g/cm³ (Cal.)