N-[(2S,3R)-3-Amino-2-Hydroxy-4-Phenylbutanoyl]-L-Valyl-L-Phenylalanine

Molecule SVG Image

Properties Simple | Detailed

Formula C24H31N3O5
IUPAC Name (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid
Molecular Mass 441.520 g·mol−1
Heat of Formation -842.9 ± 16.7 kJ·mol−1
Dipole Moment 5.18 ± 1.08 D
Volume 560.2 Å 3
Surface Area 441.17 Å 2
HOMO Energy -9.50 ± 0.55 eV
LUMO Energy 0.12 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-1-oxo-4-phenylbutyl]amino]-3-methyl-1-oxobutyl]amino]-3-phenylpropanoic acid
  • (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propanoic acid
  • (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenyl-butanoyl]amino]-3-methyl-butanoyl]amino]-3-phenyl-propionic acid
  • (2s)-2-[[(2s)-2-[[(2s,3r)-3-amino-2-hydroxy-4-phenylbutanoyl]amino]-3-methylbutanoyl]amino]-3-phenylpropanoic acid
  • l-phenylalanine, n-((2s,3r)-3-amino-2-hydroxy-1-oxo-4-phenylbuty)-l-valyl-
  • n-((2s,3r)-3-amino-2-hydroxy-1-oxo-4-phenylbuty)-l-valyl-l-phenylalanine
  • phebestin
CAS Number(s)
  • 187402-73-9
InChIKey GGMURINELPSPEF-ANULTFPQSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N