1-[(5S)-5-(Benzoylamino)-4-Oxo-6-Phenylhexanoyl]-L-Proline

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Properties Simple | Detailed

Formula C24H26N2O5
IUPAC Name (2s)-1-[(5s)-5-benzamido-4-oxo-6-phenyl-hexanoyl]pyrrolidine-2-carboxylic acid
Molecular Mass 422.474 g·mol−1
Heat of Formation -749.9 ± 16.7 kJ·mol−1
Dipole Moment 4.88 ± 1.08 D
Volume 509.67 Å 3
Surface Area 432.79 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy -0.18 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-1-[(5s)-1,4-dioxo-5-[(oxo-phenylmethyl)amino]-6-phenylhexyl]-2-pyrrolidinecarboxylic acid
  • (2s)-1-[(5s)-4-oxo-6-phenyl-5-(phenylcarbonylamino)hexanoyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(5s)-5-(benzoylamino)-4-keto-6-phenyl-hexanoyl]proline
  • (2s)-1-[(5s)-5-(benzoylamino)-4-oxo-6-phenyl-hexanoyl]pyrrolidine-2-carboxylic acid
  • (2s)-1-[(5s)-5-(benzoylamino)-4-oxo-6-phenylhexanoyl]pyrrolidine-2-carboxylic acid
  • (5s-5-benzamido-4-oxo-6-phenylhexanoyl-l-proline)
  • ketoace
  • ketomethylene analog of bz-phe-gly-pro
  • l-proline, 1-(5-(benzoylamino)-1,4-dioxo-6-phenylhexyl)-, (s)-
  • sri 20
CAS Number(s)
  • 74075-33-5
InChIKey WZJFKVHMXBGZBQ-PMACEKPBSA-N
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