N-Methyl-L-tyrosylglycylglycyl-L-phenylalanyl-L-leucyl-L-arginyl-N2-methyl-L-arginyl-D-leucyl-N-ethyl-L-Argininamide
[CAS# 103614-28-4]

Identification

• Name: N-Methyl-L-tyrosylglycylglycyl-L-phenylalanyl-L-leucyl-L-arginyl-N2-methyl-L-arginyl-D-leucyl-N-ethyl-L-Argininamide
• Synonyms: (2R)-N-[(1S)-4-(Carbamimidoyl-Ethyl-Amino)-1-Carbamoyl-Butyl]-2-[[(2S)-5-Guanidino-2-[[(2S)-5-Guanidino-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-3-(4-Hydroxyphenyl)-2-Methylamino-Propanoyl]Amino]Acetyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Pentanoyl]-Methyl-Amino]Pentanoyl]Amino]-4-Methyl-Pentanamide; (2R)-N-[(1S)-4-(Carbamimidoyl-Ethylamino)-1-Carbamoylbutyl]-2-[[(2S)-5-Guanidino-2-[[(2S)-5-Guanidino-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-3-(4-Hydroxyphenyl)-2-Methylamino-1-Oxopropyl]Amino]-1-Oxoethyl]Amino]-1-Oxoethyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-1-Oxopentyl]-Methylamino]-1-Oxopentyl]Amino]-4-Methylpentanamide; (2R)-N-[(1S)-4-(Amidino-Ethyl-Amino)-1-Carbamoyl-Butyl]-2-[[(2S)-5-Guanidino-2-[[(2S)-5-Guanidino-2-[[(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-3-(4-Hydroxyphenyl)-2-Methylamino-Propanoyl]Amino]Acetyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]Pentanoyl]-Methyl-Amino]Pentanoyl]Amino]-4-Methyl-Valeramide
• Molecular Formula: C₅₆H₉₃N₁₉O₁₀
• Molecular Weight: 1192.47
• CAS Registry Number: 103614-28-4
• SMILES: [C@H](N(C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](NC)CC1=CC=C(O)C=C1)CC2=CC=CC=C2)CC(C)C)CCCN=C(N)N)C)(CCCN=C(N)N)C(=O)N[C@H](CC(C)C)C(=O)N[C@@H](CCCN(CC)C(N)=N)C(=O)N
• InChI: 1S/C56H93N19O10/c1-8-75(56(62)63)26-14-18-38(47(57)79)70-49(81)42(28-34(4)5)73-52(84)44(19-13-25-66-55(60)61)74(7)53(85)39(17-12-24-65-54(58)59)71-50(82)41(27-33(2)3)72-51(83)43(30-35-15-10-9-11-16-35)69-46(78)32-67-45(77)31-68-48(80)40(64-6)29-36-20-22-37(76)23-21-36/h9-11,15-16,20-23,33-34,38-44,64,76H,8,12-14,17-19,24-32H2,1-7H3,(H2,57,79)(H3,62,63)(H,67,77)(H,68,80)(H,69,78)(H,70,81)(H,71,82)(H,72,83)(H,73,84)(H4,58,59,65)(H4,60,61,66)/t38-,39-,40-,41-,42+,43-,44-/m0/s1
• InChIKey: GLZQKGFWWQUHPG-RVZUTEJSSA-N

Properties

• Density: 1.348g/cm³ (Cal.)