Tyrosyl-leucyl-N-methylphenylalanyl-glutaminyl-prolyl-glutaminyl-arginyl-phenylalaninamide
[CAS# 145274-94-8]

Identification

• Name: Tyrosyl-leucyl-N-methylphenylalanyl-glutaminyl-prolyl-glutaminyl-arginyl-phenylalaninamide
• Synonyms: (2S)-2-[[(2S)-1-[(2S)-5-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]-Methyl-Amino]-4-Methyl-Pentanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-5-Oxo-Pentanoyl]Pyrrolidine-2-Carbonyl]Amino]-N-[(1S)-1-[[(1S)-2-Amino-2-Oxo-1-(Phenylmethyl)Ethyl]Carbamoyl]-4-Guanidino-Butyl]Pentanediamide; (2S)-2-[[[(2S)-1-[(2S)-5-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)-1-Oxopropyl]-Methylamino]-4-Methyl-1-Oxopentyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-1,5-Dioxopentyl]-2-Pyrrolidinyl]-Oxomethyl]Amino]-N-[(1S)-1-[[[(1S)-2-Amino-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]-Oxomethyl]-4-Guanidinobutyl]Pentanediamide; (2S)-2-[[(2S)-1-[(2S)-5-Amino-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-Amino-3-(4-Hydroxyphenyl)Propanoyl]-Methyl-Amino]-4-Methyl-Pentanoyl]Amino]-3-Phenyl-Propanoyl]Amino]-5-Keto-Pentanoyl]Pyrrolidine-2-Carbonyl]Amino]-N-[(1S)-1-[[(1S)-2-Amino-1-(Benzyl)-2-Keto-Ethyl]Carbamoyl]-4-Guanidino-Butyl]Glutaramide
• Molecular Formula: C₅₅H₇₈N₁₄O₁₁
• Molecular Weight: 1111.31
• CAS Registry Number: 145274-94-8
• SMILES: [C@@H]1(N(CCC1)C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N(C(=O)[C@@H](N)CC2=CC=C(O)C=C2)C)CC(C)C)CC3=CC=CC=C3)CCC(=O)N)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N
• InChI: 1S/C55H78N14O11/c1-32(2)28-44(68(3)53(79)37(56)29-35-18-20-36(70)21-19-35)52(78)67-42(31-34-14-8-5-9-15-34)50(76)65-40(23-25-46(58)72)54(80)69-27-11-17-43(69)51(77)64-39(22-24-45(57)71)49(75)63-38(16-10-26-62-55(60)61)48(74)66-41(47(59)73)30-33-12-6-4-7-13-33/h4-9,12-15,18-21,32,37-44,70H,10-11,16-17,22-31,56H2,1-3H3,(H2,57,71)(H2,58,72)(H2,59,73)(H,63,75)(H,64,77)(H,65,76)(H,66,74)(H,67,78)(H4,60,61,62)/t37-,38-,39-,40-,41-,42-,43-,44-/m0/s1
• InChIKey: UQGBICZACVFETI-YTAGXALCSA-N

Properties

• Density: 1.394g/cm³ (Cal.)