Methyl (9α,11α,13E,15R)-9,11,15-Trihydroxy-15-Methylprosta-4,5,13-Trien-1-Oate

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Properties Simple | Detailed

Formula C22H36O5
IUPAC Name methyl 7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3r)-3-hydroxy-3-methyl-oct-1-enyl]cyclopentyl]hepta-4,5-dienoate
Molecular Mass 380.518 g·mol−1
Heat of Formation -990.0 ± 16.7 kJ·mol−1
Dipole Moment 2.11 ± 1.08 D
Volume 514.6 Å 3
Surface Area 459.94 Å 2
HOMO Energy -9.84 ± 0.55 eV
LUMO Energy 0.46 ± eV
Point Group Symmetry C1
Synonyms
  • (+-)-methyl 7-((1r*,2r*,3r*,5s*)-3,5-dihydroxy-2-((e)-3-hydroxy-3-methyl-1-octenyl)cyclopentyl)-4,5-heptadienoate
  • 7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3r)-3-hydroxy-3-methyl-oct-1-enyl]cyclopentyl]hepta-4,5-dienoic acid methyl ester
  • 7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3r)-3-hydroxy-3-methyloct-1-enyl]cyclopentyl]hepta-4,5-dienoic acid methyl ester
  • d05642
  • methyl 7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3r)-3-hydroxy-3-methyl-oct-1-enyl]cyclopentyl]hepta-4,5-dienoate
  • methyl 7-[(1r,2r,3r,5s)-3,5-dihydroxy-2-[(e,3r)-3-hydroxy-3-methyloct-1-enyl]cyclopentyl]hepta-4,5-dienoate
  • prosta-4,5,13-trien-1-oic acid, 9,11,15-trihydroxy-15-methyl-, methyl ester, (9alpha,11alpha,13e)-, (+-)-
  • prostalene
  • prostalene (usan)
  • rs9390
  • synchrocept
  • synchrocept (veterinary)
CAS Number(s)
  • 54120-61-5
InChIKey GNIYHUSSKSFYBD-MFZPGRHISA-N
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