Arbaprostil

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Properties Simple | Detailed

Formula C21H34O5
IUPAC Name (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-3-methyl-oct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
Molecular Mass 366.492 g·mol−1
Heat of Formation -1135.2 ± 16.7 kJ·mol−1
Dipole Moment 4.04 ± 1.08 D
Volume 483.74 Å 3
Surface Area 365.07 Å 2
HOMO Energy -9.55 ± 0.55 eV
LUMO Energy 0.87 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-3-methyl-oct-1-enyl]-5-keto-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-3-methyl-oct-1-enyl]-5-oxo-cyclopentyl]hept-5-enoic acid
  • (z)-7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r)-3-hydroxy-3-methyloct-1-enyl]-5-oxocyclopentyl]hept-5-enoic acid
  • 15-methyl-15r-pge2
  • 9-oxo-11r,15r-dihydroxy-15-methyl-5z,13e-prostadienoic acid
  • arbaprostil (usan)
  • arbastyl
  • cu-83
  • d02975
  • lmfa03010063
  • u-42842
InChIKey XSGQFHNPNWBVPT-VFXMVCAWSA-N
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Elements H C O