Isopropyl (5Z,9α,11α,13E,15S)-9,11,15-Trihydroxyprosta-5,13-Dien-1-Oate

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Properties Simple | Detailed

Formula C23H40O5
IUPAC Name isopropyl (z)-7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoate
Molecular Mass 396.561 g·mol−1
Heat of Formation -1173.7 ± 16.7 kJ·mol−1
Dipole Moment 2.67 ± 1.08 D
Volume 549.98 Å 3
Surface Area 425.9 Å 2
HOMO Energy -9.77 ± 0.55 eV
LUMO Energy 0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (z)-7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoic acid isopropyl ester
  • dinoprost isopropyl ester
  • isopropyl (z)-7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3s)-3-hydroxyoct-1-enyl]cyclopentyl]hept-5-enoate
  • isopropyl 9s,11r,15s-trihydroxy-5z,13e-prostadienoate
  • lmfa03010076
  • pgf2 isopropyl ester
  • pgf2alpha isopropyl ester
  • pgf2alpha-1-isopropyl ester
  • prosta-5,13-dien-1-oic acid, 9,11,15-trihydroxy-, 1-methylethyl ester, (5z,9alpha,11alpha,13e,15s)-
  • prostaglandin f2 isopropyl ester
CAS Number(s)
  • 53764-90-2
InChIKey FPABVZYYTCHNMK-YNRDDPJXSA-N
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