Ranyl Ester

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Properties Simple | Detailed

Formula C36H39N3O7
IUPAC Name [(3s)-tetrahydrofuran-3-yl] n-[(1s,2s)-1-benzyl-3-[(2s)-2-benzyl-4-[(1r,2r)-2-carbamoyloxyindan-1-yl]-3-oxo-1h-pyrrol-2-yl]-2-hydroxy-propyl]carbamate
Molecular Mass 625.711 g·mol−1
Heat of Formation -994.7 ± 16.7 kJ·mol−1
Dipole Moment 7.05 ± 1.08 D
Volume 746.94 Å 3
Surface Area 537.79 Å 2
HOMO Energy -8.82 ± 0.55 eV
LUMO Energy 2.97 ± eV
Point Group Symmetry C1
Synonyms
  • [(1r,2r)-1-[(5s)-5-[(2s,3s)-2-hydroxy-3-[[(3s)-oxolan-3-yl]oxycarbonylamino]-4-phenyl-butyl]-4-oxo-5-(phenylmethyl)-1h-pyrrol-3-yl]-2,3-dihydro-1h-inden-2-yl] carbamate
  • [(1r,2r)-1-[(5s)-5-[(2s,3s)-2-hydroxy-3-[[(3s)-oxolan-3-yl]oxycarbonylamino]-4-phenylbutyl]-4-oxo-5-(phenylmethyl)-1h-pyrrol-3-yl]-2,3-dihydro-1h-inden-2-yl] carbamate
  • [(1r,2r)-1-[(5s)-5-[(2s,3s)-2-hydroxy-4-phenyl-3-[[(3s)-tetrahydrofuran-3-yl]oxycarbonylamino]butyl]-4-oxo-5-(phenylmethyl)-1h-pyrrol-3-yl]indan-2-yl] carbamate
  • carbamic acid [(1r,2r)-1-[(5s)-5-(benzyl)-5-[(2s,3s)-2-hydroxy-4-phenyl-3-[[(3s)-tetrahydrofuran-3-yl]oxycarbonylamino]butyl]-4-keto-2-pyrrolin-3-yl]indan-2-yl] ester
  • carbamic acid [(1r,2r)-1-[(5s)-5-[(2s,3s)-2-hydroxy-3-[[oxo-[[(3s)-3-tetrahydrofuranyl]oxy]methyl]amino]-4-phenylbutyl]-4-oxo-5-(phenylmethyl)-1h-pyrrol-3-yl]-2-indanyl] ester
  • carbamic acid, [(1s,2s)-3-[(2s)-4-[(1r,2r)-2-[(aminocarbonyl)oxy]-2,3-dihydro-1h-inden-1-yl]-2,3-dihydro-3-oxo-2-(phenylmethyl)-1h-pyrrol-2-yl]-2-hydroxy-1-(phenylmethyl)propyl]-, (3s)-tetrahydro-3-furanyl ester
InChIKey LIIUTXFOEDWJEK-YXCXSNCSSA-N
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