[(1R)-2-(4-Hydroxyphenyl)-1-[[(1S)-1-[[(2S)-3-Methyl-2-Methylamino-Butanoyl]Carbamoyl]-2-Phenyl-Ethyl]Amino]Ethyl]Phosphonic Acid
[CAS# 84890-90-4]

Identification

• Name: [(1R)-2-(4-Hydroxyphenyl)-1-[[(1S)-1-[[(2S)-3-Methyl-2-Methylamino-Butanoyl]Carbamoyl]-2-Phenyl-Ethyl]Amino]Ethyl]Phosphonic Acid
• Synonyms: [(1R)-2-(4-Hydroxyphenyl)-1-[[(1S)-2-[[(2S)-3-Methyl-2-Methylamino-Butanoyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]Ethyl]Phosphonic Acid; [(1R)-2-(4-Hydroxyphenyl)-1-[[(1S)-2-[[(2S)-3-Methyl-2-Methylamino-1-Oxobutyl]Amino]-2-Oxo-1-(Phenylmethyl)Ethyl]Amino]Ethyl]Phosphonic Acid; [(1R)-1-[[(1S)-1-(Benzyl)-2-Keto-2-[[(2S)-3-Methyl-2-Methylamino-Butanoyl]Amino]Ethyl]Amino]-2-(4-Hydroxyphenyl)Ethyl]Phosphonic Acid
• Molecular Formula: C₂₃H₃₂N₃O₆P
• Molecular Weight: 477.50
• CAS Registry Number: 84890-90-4
• SMILES: [C@H](C(=O)NC([C@@H](NC)C(C)C)=O)(N[C@@H](CC1=CC=C(C=C1)O)[P](=O)(O)O)CC2=CC=CC=C2
• InChI: 1S/C23H32N3O6P/c1-15(2)21(24-3)23(29)26-22(28)19(13-16-7-5-4-6-8-16)25-20(33(30,31)32)14-17-9-11-18(27)12-10-17/h4-12,15,19-21,24-25,27H,13-14H2,1-3H3,(H,26,28,29)(H2,30,31,32)/t19-,20+,21-/m0/s1
• InChIKey: ATQVBSVAXDRWFW-HBMCJLEFSA-N

Properties

• Density: 1.286g/cm³ (Cal.)