(4S,5R)-5-[(1R,2S)-1-Acetamido-2-Methoxy-2-Methylpentyl]-4-[(1Z)-1-Propen-1-Yl]-D-Proline

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Properties Simple | Detailed

Formula C17H30N2O4
IUPAC Name (2r,4s,5r)-5-[(1r,2s)-1-acetamido-2-methoxy-2-methyl-pentyl]-4-[(z)-prop-1-enyl]pyrrolidine-2-carboxylic acid
Molecular Mass 326.431 g·mol−1
Heat of Formation -858.9 ± 16.7 kJ·mol−1
Dipole Moment 2.84 ± 1.08 D
Volume 425.92 Å 3
Surface Area 343.65 Å 2
HOMO Energy -9.21 ± 0.55 eV
LUMO Energy 0.86 ± eV
Point Group Symmetry C1
Synonyms
  • (2r,4s,5r)-5-[(1r,2s)-1-acetamido-2-methoxy-2-methyl-pentyl]-4-[(z)-prop-1-enyl]proline
  • (2r,4s,5r)-5-[(1r,2s)-1-acetamido-2-methoxy-2-methyl-pentyl]-4-[(z)-prop-1-enyl]pyrrolidine-2-carboxylic acid
  • (2r,4s,5r)-5-[(1r,2s)-1-acetamido-2-methoxy-2-methylpentyl]-4-[(z)-prop-1-enyl]-2-pyrrolidinecarboxylic acid
  • (2r,4s,5r)-5-[(1r,2s)-1-acetamido-2-methoxy-2-methylpentyl]-4-[(z)-prop-1-enyl]pyrrolidine-2-carboxylic acid
  • 5-((2s,1r)-1-(acetylamino)-2-methoxy-2-methylpentyl)(4s,2r)-4-(prop-1-enyl)pyrrolidine-2-carboxylic acid
  • 5-[(2s,1r)-1-(acetylamino)-2-methoxy-2-methylpentyl](4s,2r)-4-(prop-1-enyl)pyrrolidine-2-carboxylic acid
  • a 315675
  • a-315675
  • d-proline, 5-((1r,2s)-1-(acetylamino)-2-methoxy-2-methylpentyl)-4-(1z)-1-propenyl-, (4s,5r)-
  • d-proline, 5-[(1r,2s)-1-(acetylamino)-2-methoxy-2-methylpentyl]-4-(1z)-1-propenyl-, (4s,5r)-
CAS Number(s)
  • 335679-69-1
InChIKey UUVKABIGWGMYCE-FLMGFEAJSA-N
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