Tert-Butyl N-[(2S,3R)-3-Hydroxy-4-[[(2R,3S)-2-Hydroxy-3-[(2-Methylpropan-2-Yl)Oxycarbonylamino]-4-Phenylbutyl]Amino]-1-[4-(2-Pyridin-2-Ylethoxy)Phenyl]Butan-2-Yl]Carbamate
[CAS# 162539-57-3]

Identification

• Name: Tert-Butyl N-[(2S,3R)-3-Hydroxy-4-[[(2R,3S)-2-Hydroxy-3-[(2-Methylpropan-2-Yl)Oxycarbonylamino]-4-Phenylbutyl]Amino]-1-[4-(2-Pyridin-2-Ylethoxy)Phenyl]Butan-2-Yl]Carbamate
• Synonyms: Tert-Butyl N-[(1S,2R)-3-[[(2R,3S)-3-(Tert-Butoxycarbonylamino)-2-Hydroxy-4-Phenyl-Butyl]Amino]-2-Hydroxy-1-[[4-[2-(2-Pyridyl)Ethoxy]Phenyl]Methyl]Propyl]Carbamate; N-[(1S,2R)-3-[[(2R,3S)-3-[(Tert-Butoxy-Oxomethyl)Amino]-2-Hydroxy-4-Phenylbutyl]Amino]-2-Hydroxy-1-[[4-[2-(2-Pyridyl)Ethoxy]Phenyl]Methyl]Propyl]Carbamic Acid Tert-Butyl Ester; N-[(1S,2R)-3-[[(2R,3S)-3-(Tert-Butoxycarbonylamino)-2-Hydroxy-4-Phenyl-Butyl]Amino]-2-Hydroxy-1-[4-[2-(2-Pyridyl)Ethoxy]Benzyl]Propyl]Carbamic Acid Tert-Butyl Ester
• Molecular Formula: C₃₇H₅₂N₄O₇
• Molecular Weight: 664.84
• CAS Registry Number: 162539-57-3
• SMILES: [C@@H](NC(OC(C)(C)C)=O)([C@H](O)CNC[C@H]([C@@H](NC(OC(C)(C)C)=O)CC1=CC=CC=C1)O)CC2=CC=C(C=C2)OCCC3=NC=CC=C3
• InChI: 1S/C37H52N4O7/c1-36(2,3)47-34(44)40-30(22-26-12-8-7-9-13-26)32(42)24-38-25-33(43)31(41-35(45)48-37(4,5)6)23-27-15-17-29(18-16-27)46-21-19-28-14-10-11-20-39-28/h7-18,20,30-33,38,42-43H,19,21-25H2,1-6H3,(H,40,44)(H,41,45)/t30-,31-,32+,33+/m0/s1
• InChIKey: XGSPSWMOULVMMN-UYEZAFAQSA-N

Properties

• Density: 1.163g/cm³ (Cal.)
• Boiling point: 818.627°C at 760 mmHg (Cal.)
• Flash point: 448.889°C (Cal.)