Prost-13-En-1-Oic Acid, 11,15-Dihydroxy-17,20-Dimethyl-6,9-Dioxo-, Methyl Ester, (11α,13E,15R,17S)-

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Properties Simple | Detailed

Formula C23H38O6
IUPAC Name methyl 7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r,5s)-3-hydroxy-5-methyl-non-1-enyl]-5-oxo-cyclopentyl]-6-oxo-heptanoate
Molecular Mass 410.544 g·mol−1
Heat of Formation -1309.6 ± 16.7 kJ·mol−1
Dipole Moment 1.27 ± 1.08 D
Volume 549.49 Å 3
Surface Area 423.6 Å 2
HOMO Energy -10.06 ± 0.55 eV
LUMO Energy 0.44 ± eV
Point Group Symmetry C1
Synonyms
  • 17,20-dimethyl-6-oxo-pge1 me ester
  • 17,20-dimethyl-6-oxo-prostaglandin e1 methyl ester
  • 7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r,5s)-3-hydroxy-5-methyl-non-1-enyl]-5-keto-cyclopentyl]-6-keto-enanthic acid methyl ester
  • 7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r,5s)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]-6-oxoheptanoic acid methyl ester
  • methyl 7-[(1r,2r,3r)-3-hydroxy-2-[(e,3r,5s)-3-hydroxy-5-methylnon-1-enyl]-5-oxocyclopentyl]-6-oxoheptanoate
  • ou-1308
CAS Number(s)
  • 85679-51-2
InChIKey BBRBUTFBTUFFBU-VZZCMBKRSA-N
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