O-((-((N-(Phenylmethoxycarbonyl)Alanyl)Amino)Ethyl)Hydroxyphosphinyl)-3-Phenylacetate
[CAS# 127305-92-4]

Identification

• Name: O-((-((N-(Phenylmethoxycarbonyl)Alanyl)Amino)Ethyl)Hydroxyphosphinyl)-3-Phenylacetate
• Synonyms: (2S)-2-[Hydroxy-[(1R)-1-[[(2S)-2-(Phenylmethoxycarbonylamino)Propanoyl]Amino]Ethyl]Phosphoryl]Oxy-3-Phenyl-Propanoic Acid; (2S)-2-[Hydroxy-[(1R)-1-[[(2S)-1-Oxo-2-[[Oxo-(Phenylmethoxy)Methyl]Amino]Propyl]Amino]Ethyl]Phosphoryl]Oxy-3-Phenylpropanoic Acid; (2S)-2-[[(1R)-1-[[(2S)-2-(Benzyloxycarbonylamino)Propanoyl]Amino]Ethyl]-Hydroxy-Phosphoryl]Oxy-3-Phenyl-Propionic Acid
• Molecular Formula: C₂₂H₂₇N₂O₈P
• Molecular Weight: 478.44
• CAS Registry Number: 127305-92-4
• SMILES: [C@H]([P](O[C@@H](CC1=CC=CC=C1)C(=O)O)(=O)O)(NC(=O)[C@@H](NC(OCC2=CC=CC=C2)=O)C)C
• InChI: 1S/C22H27N2O8P/c1-15(23-22(28)31-14-18-11-7-4-8-12-18)20(25)24-16(2)33(29,30)32-19(21(26)27)13-17-9-5-3-6-10-17/h3-12,15-16,19H,13-14H2,1-2H3,(H,23,28)(H,24,25)(H,26,27)(H,29,30)/t15-,16+,19-/m0/s1
• InChIKey: UPJNMOBJDSFRTI-FCEWJHQRSA-N

Properties

• Density: 1.34g/cm³ (Cal.)