L-Phenylalanyl-L-arginyl-L-tryptophylglycyl-L-lysyl-L-prolyl-L-valylglycyl-L-lysyl-L-Lysinamide
[CAS# 57241-86-8]

Identification

• Name: L-Phenylalanyl-L-arginyl-L-tryptophylglycyl-L-lysyl-L-prolyl-L-valylglycyl-L-lysyl-L-Lysinamide
• Synonyms: (2S)-N-[(1S)-1-[[2-[[(1S)-5-Amino-1-[[(1S)-5-Amino-1-Carbamoyl-Pentyl]Carbamoyl]Pentyl]Amino]-2-Oxo-Ethyl]Carbamoyl]-2-Methyl-Propyl]-1-[(2S)-6-Amino-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-Phenyl-Propanoyl]Amino]-5-Guanidino-Pentanoyl]Amino]-3-(1H-Indol-3-Yl)Propanoyl]Amino]Acetyl]Amino]Hexanoyl]Pyrrolidine-2-Carboxamide; (2S)-N-[(1S)-1-[[[2-[[(1S)-5-Amino-1-[[[(1S)-5-Amino-1-Carbamoylpentyl]Amino]-Oxomethyl]Pentyl]Amino]-2-Oxoethyl]Amino]-Oxomethyl]-2-Methylpropyl]-1-[(2S)-6-Amino-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-1-Oxo-3-Phenylpropyl]Amino]-5-Guanidino-1-Oxopentyl]Amino]-3-(1H-Indol-3-Yl)-1-Oxopropyl]Amino]-1-Oxoethyl]Amino]-1-Oxohexyl]-2-Pyrrolidinecarboxamide; (2S)-N-[(1S)-1-[[2-[[(1S)-5-Amino-1-[[(1S)-5-Amino-1-Carbamoyl-Pentyl]Carbamoyl]Pentyl]Amino]-2-Keto-Ethyl]Carbamoyl]-2-Methyl-Propyl]-1-[(2S)-6-Amino-2-[[2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-Phenyl-Propanoyl]Amino]-5-Guanidino-Pentanoyl]Amino]-3-(1H-Indol-3-Yl)Propanoyl]Amino]Acetyl]Amino]Hexanoyl]Pyrrolidine-2-Carboxamide
• Molecular Formula: C₅₈H₉₂N₁₈O₁₀
• Molecular Weight: 1201.48
• CAS Registry Number: 57241-86-8
• SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC2=CC=CC=C2)CCCN=C(N)N)CC3=C[NH]C4=CC=CC=C34)CCCCN)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N
• InChI: 1S/C58H92N18O10/c1-35(2)49(56(85)69-34-47(77)70-42(21-9-12-26-60)53(82)72-41(50(63)79)20-8-11-25-59)75-55(84)46-24-15-29-76(46)57(86)44(22-10-13-27-61)71-48(78)33-68-52(81)45(31-37-32-67-40-19-7-6-18-38(37)40)74-54(83)43(23-14-28-66-58(64)65)73-51(80)39(62)30-36-16-4-3-5-17-36/h3-7,16-19,32,35,39,41-46,49,67H,8-15,20-31,33-34,59-62H2,1-2H3,(H2,63,79)(H,68,81)(H,69,85)(H,70,77)(H,71,78)(H,72,82)(H,73,80)(H,74,83)(H,75,84)(H4,64,65,66)/t39-,41-,42-,43-,44-,45-,46-,49-/m0/s1
• InChIKey: HTQNAQFVDAMSPJ-XAPJERKZSA-N

Properties

• Density: 1.408g/cm³ (Cal.)