N-[(R)-({[(Benzyloxy)Carbonyl]Amino}Methyl)(Hydroxy)Phosphoryl]-L-Leucyl-L-Leucine

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Formula C21H34N3O7P
IUPAC Name (2s)-2-[[(2s)-2-[[benzyloxycarbonylaminomethyl(hydroxy)phosphoryl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid
Molecular Mass 471.484 g·mol−1
Heat of Formation -1573.9 ± 16.7 kJ·mol−1
Dipole Moment 4.54 ± 1.08 D
Volume 574.54 Å 3
Surface Area 480.51 Å 2
HOMO Energy -9.26 ± 0.55 eV
LUMO Energy -0.20 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-2-[[(benzyloxycarbonylamino)methyl-hydroxy-phosphoryl]amino]-4-methyl-pentanoyl]amino]-4-methyl-valeric acid
  • (2s)-2-[[(2s)-2-[[hydroxy-[(phenylmethoxycarbonylamino)methyl]phosphoryl]amino]-4-methyl-pentanoyl]amino]-4-methyl-pentanoic acid
  • (2s)-2-[[(2s)-2-[[hydroxy-[(phenylmethoxycarbonylamino)methyl]phosphoryl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid
  • (2s)-2-[[(2s)-2-[[hydroxy-[[[oxo-(phenylmethoxy)methyl]amino]methyl]phosphoryl]amino]-4-methyl-1-oxopentyl]amino]-4-methylpentanoic acid
InChIKey ASUDVBNLLSQCDJ-ROUUACIJSA-N
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