(1,1-Dimethylethoxy)carbonyl-tyrosyl-prolyl-glycyl-phenylalanyl-leucyl-threonine
[CAS# 141261-96-3]

Identification

• Name: (1,1-Dimethylethoxy)carbonyl-tyrosyl-prolyl-glycyl-phenylalanyl-leucyl-threonine
• Synonyms: (2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-2-(Tert-Butoxycarbonylamino)-3-(4-Hydroxyphenyl)Propanoyl]Pyrrolidine-2-Carbonyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-3-Hydroxy-Butanoic Acid; (2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[[(2S)-1-[(2S)-2-[(Tert-Butoxy-Oxomethyl)Amino]-3-(4-Hydroxyphenyl)-1-Oxopropyl]-2-Pyrrolidinyl]-Oxomethyl]Amino]-1-Oxoethyl]Amino]-1-Oxo-3-Phenylpropyl]Amino]-4-Methyl-1-Oxopentyl]Amino]-3-Hydroxybutanoic Acid; (2S,3R)-2-[[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-2-(Tert-Butoxycarbonylamino)-3-(4-Hydroxyphenyl)Propanoyl]Pyrrolidine-2-Carbonyl]Amino]Acetyl]Amino]-3-Phenyl-Propanoyl]Amino]-4-Methyl-Pentanoyl]Amino]-3-Hydroxy-Butyric Acid
• Molecular Formula: C₄₀H₅₆N₆O₁₁
• Molecular Weight: 796.92
• CAS Registry Number: 141261-96-3
• SMILES: [C@H](C(=O)O)(NC([C@@H](NC([C@@H](NC(CNC([C@H]1N(CCC1)C([C@@H](NC(=O)OC(C)(C)C)CC2=CC=C(O)C=C2)=O)=O)=O)CC3=CC=CC=C3)=O)CC(C)C)=O)[C@@H](C)O
• InChI: 1S/C40H56N6O11/c1-23(2)19-28(35(51)45-33(24(3)47)38(54)55)43-34(50)29(20-25-11-8-7-9-12-25)42-32(49)22-41-36(52)31-13-10-18-46(31)37(53)30(44-39(56)57-40(4,5)6)21-26-14-16-27(48)17-15-26/h7-9,11-12,14-17,23-24,28-31,33,47-48H,10,13,18-22H2,1-6H3,(H,41,52)(H,42,49)(H,43,50)(H,44,56)(H,45,51)(H,54,55)/t24-,28+,29+,30+,31+,33+/m1/s1
• InChIKey: HMZMYOYMDHRAIZ-GYKAHYMZSA-N
• Protein Sequence: Boc-Tyr-Pro-Gly-Phe-Leu-Thr-OH

Properties

• Density: 1.274g/cm³ (Cal.)
• Boiling point: 1153.673°C at 760 mmHg (Cal.)
• Flash point: 651.518°C (Cal.)