[(3S)-Oxolan-3-Yl] N-[(2S,3S)-4-[(2S)-4-[(2S)-4-[(2R)-1-(Tert-Butylamino)-1-Oxo-3-Phenylpropan-2-Yl]-2-(2-Methylpropyl)-3-Oxo-1H-Pyrrol-2-Yl]-3-Oxo-2-(Phenylmethyl)-1H-Pyrrol-2-Yl]-3-Hydroxy-1-Phenylbutan-2-Yl]Carbamate
[CAS# 173091-97-9]

Identification

• Name: [(3S)-Oxolan-3-Yl] N-[(2S,3S)-4-[(2S)-4-[(2S)-4-[(2R)-1-(Tert-Butylamino)-1-Oxo-3-Phenylpropan-2-Yl]-2-(2-Methylpropyl)-3-Oxo-1H-Pyrrol-2-Yl]-3-Oxo-2-(Phenylmethyl)-1H-Pyrrol-2-Yl]-3-Hydroxy-1-Phenylbutan-2-Yl]Carbamate
• Synonyms: [(3S)-Tetrahydrofuran-3-Yl] N-[(1S,2S)-3-[(2S)-4-[(2S)-4-[(1R)-2-(Tert-Butylamino)-2-Oxo-1-(Phenylmethyl)Ethyl]-2-Isobutyl-3-Oxo-1H-Pyrrol-2-Yl]-3-Oxo-2-(Phenylmethyl)-1H-Pyrrol-2-Yl]-2-Hydroxy-1-(Phenylmethyl)Propyl]Carbamate; N-[(1S,2S)-3-[(2S)-4-[(2S)-4-[(1R)-2-(Tert-Butylamino)-2-Oxo-1-(Phenylmethyl)Ethyl]-2-Isobutyl-3-Oxo-1H-Pyrrol-2-Yl]-3-Oxo-2-(Phenylmethyl)-1H-Pyrrol-2-Yl]-2-Hydroxy-1-(Phenylmethyl)Propyl]Carbamic Acid [(3S)-3-Tetrahydrofuranyl] Ester; N-[(1S,2S)-1-(Benzyl)-3-[(2S)-2-(Benzyl)-4-[(2S)-4-[(1R)-1-(Benzyl)-2-(Tert-Butylamino)-2-Keto-Ethyl]-2-Isobutyl-3-Keto-2-Pyrrolin-2-Yl]-3-Keto-2-Pyrrolin-2-Yl]-2-Hydroxy-Propyl]Carbamic Acid [(3S)-Tetrahydrofuran-3-Yl] Ester
• Molecular Formula: C₄₇H₅₈N₄O₇
• Molecular Weight: 791.00
• CAS Registry Number: 173091-97-9
• SMILES: [C@@]1(NC=C(C1=O)[C@H](C(=O)NC(C)(C)C)CC2=CC=CC=C2)(C3=CN[C@](C3=O)(C[C@H](O)[C@@H](NC(O[C@@H]4COCC4)=O)CC5=CC=CC=C5)CC6=CC=CC=C6)CC(C)C
• InChI: 1S/C47H58N4O7/c1-31(2)25-47(41(53)37(28-49-47)36(43(55)51-45(3,4)5)23-32-15-9-6-10-16-32)38-29-48-46(42(38)54,26-34-19-13-8-14-20-34)27-40(52)39(24-33-17-11-7-12-18-33)50-44(56)58-35-21-22-57-30-35/h6-20,28-29,31,35-36,39-40,48-49,52H,21-27,30H2,1-5H3,(H,50,56)(H,51,55)/t35-,36+,39-,40-,46-,47-/m0/s1
• InChIKey: CQYRFIYZAKSRRG-UPMBQMLSSA-N

Properties

• Density: 1.241g/cm³ (Cal.)
• Boiling point: 964.666°C at 760 mmHg (Cal.)
• Flash point: 537.211°C (Cal.)