(7R,8S)-8-Benzyl-7-Hydroxy-4,10-Dioxo-1-Phenyl-6-Oxa-3,9-Diaza-7-Phosphatetradecan-14-Oic Acid 7-Oxide

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Properties Simple | Detailed

Formula C23H29N2O7P
IUPAC Name 5-[[(1s)-1-[hydroxy-[2-oxo-2-(2-phenylethylamino)ethoxy]phosphoryl]-2-phenyl-ethyl]amino]-5-oxo-pentanoic acid
Molecular Mass 476.459 g·mol−1
Heat of Formation -1442.2 ± 16.7 kJ·mol−1
Dipole Moment 2.55 ± 1.08 D
Volume 565.11 Å 3
Surface Area 456.38 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy 2.82 ± eV
Point Group Symmetry C1
Synonyms
  • 5-[[(1s)-1-[hydroxy-[2-keto-2-(2-phenylethylamino)ethoxy]phosphoryl]-2-phenyl-ethyl]amino]-5-keto-valeric acid
  • 5-[[(1s)-1-[hydroxy-[2-oxo-2-(2-phenylethylamino)ethoxy]phosphoryl]-2-phenyl-ethyl]amino]-5-oxo-pentanoic acid
  • 5-[[(1s)-1-[hydroxy-[2-oxo-2-(2-phenylethylamino)ethoxy]phosphoryl]-2-phenylethyl]amino]-5-oxopentanoic acid
  • hal
  • n-{[2-({[1-(4-carboxybutanoyl)amino]-2-phenylethyl}-hydroxyphosphinyl)oxy]acetyl}-2-phenylethylamine
InChIKey DKQZZKSBRCTCQU-QFIPXVFZSA-N
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