L-Lysyl-L-histidyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-arginyl-L-Phenylalaninamide
[CAS# 146269-94-5]

Identification

• Name: L-Lysyl-L-histidyl-L-alpha-glutamyl-L-tyrosyl-L-leucyl-L-arginyl-L-Phenylalaninamide
• Synonyms: (4S)-5-[[(1S)-2-[[(1S)-1-[[(1S)-1-[[(1S)-2-Amino-2-Oxo-1-(Phenylmethyl)Ethyl]Carbamoyl]-4-Guanidino-Butyl]Carbamoyl]-3-Methyl-Butyl]Amino]-1-[(4-Hydroxyphenyl)Methyl]-2-Oxo-Ethyl]Amino]-4-[[(2S)-2-[[(2S)-2,6-Diaminohexanoyl]Amino]-3-(4H-Imidazol-4-Yl)Propanoyl]Amino]-5-Oxo-Pentanoic Acid; (4S)-5-[[(1S)-2-[[(1S)-1-[[[(1S)-1-[[[(1S)-2-Amino-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-Oxomethyl]-4-Guanidinobutyl]Amino]-Oxomethyl]-3-Methylbutyl]Amino]-1-[(4-Hydroxyphenyl)Methyl]-2-Oxoethyl]Amino]-4-[[(2S)-2-[[(2S)-2,6-Diamino-1-Oxohexyl]Amino]-3-(4H-Imidazol-4-Yl)-1-Oxopropyl]Amino]-5-Oxopentanoic Acid; (4S)-5-[[(1S)-2-[[(1S)-1-[[(1S)-1-[[(1S)-2-Amino-1-(Benzyl)-2-Keto-Ethyl]Carbamoyl]-4-Guanidino-Butyl]Carbamoyl]-3-Methyl-Butyl]Amino]-1-(4-Hydroxybenzyl)-2-Keto-Ethyl]Amino]-4-[[(2S)-2-[[(2S)-2,6-Diaminohexanoyl]Amino]-3-(4H-Imidazol-4-Yl)Propanoyl]Amino]-5-Keto-Valeric Acid
• Molecular Formula: C₄₇H₇₀N₁₄O₁₀
• Molecular Weight: 991.16
• CAS Registry Number: 146269-94-5
• SMILES: [C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)CC1N=CN=C1)CCC(O)=O)CC2=CC=C(O)C=C2)(CC(C)C)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N
• InChI: 1S/C47H70N14O10/c1-27(2)21-36(44(69)56-33(12-8-20-54-47(51)52)42(67)58-35(40(50)65)22-28-9-4-3-5-10-28)60-45(70)37(23-29-13-15-31(62)16-14-29)61-43(68)34(17-18-39(63)64)57-46(71)38(24-30-25-53-26-55-30)59-41(66)32(49)11-6-7-19-48/h3-5,9-10,13-16,25-27,30,32-38,62H,6-8,11-12,17-24,48-49H2,1-2H3,(H2,50,65)(H,56,69)(H,57,71)(H,58,67)(H,59,66)(H,60,70)(H,61,68)(H,63,64)(H4,51,52,54)/t30?,32-,33-,34-,35-,36-,37-,38-/m0/s1
• InChIKey: MGOKUNODPHLKLV-NDXBOBJVSA-N

Properties

• Density: 1.421g/cm³ (Cal.)