1-[(2S)-2-Methyl-3-Sulfanylpropanoyl]-L-Prolyl-L-Phenylalanine

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Formula C18H24N2O4S
IUPAC Name (2s)-2-[[(2s)-1-[(2s)-2-methyl-3-sulfanyl-propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoic acid
Molecular Mass 364.459 g·mol−1
Heat of Formation -743.7 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 441.54 Å 3
Surface Area 347.75 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy -0.19 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-2-[[(2s)-1-[(2s)-2-methyl-3-sulfanyl-propanoyl]pyrrolidin-2-yl]carbonylamino]-3-phenyl-propanoic acid
  • (2s)-2-[[(2s)-1-[(2s)-2-methyl-3-sulfanyl-propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl-propanoic acid
  • (2s)-2-[[(2s)-1-[(2s)-2-methyl-3-sulfanylpropanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoic acid
  • (2s)-2-[[(2s)-1-[(2s)-3-mercapto-2-methyl-propanoyl]pyrrolidine-2-carbonyl]amino]-3-phenyl-propionic acid
  • (2s)-2-[[[(2s)-1-[(2s)-3-mercapto-2-methyl-1-oxopropyl]-2-pyrrolidinyl]-oxomethyl]amino]-3-phenylpropanoic acid
  • desacetyl-alacepril
  • du 1227
  • du-1227
  • l-phenylalanine, n-(1-(3-mercapto-2-methyl-1-oxopropyl)-l-prolyl)-, (s)-
CAS Number(s)
  • 74259-08-8
InChIKey GICPPYOSOHKZPY-SNPRPXQTSA-N
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