(5Z,8beta,9beta,11alpha,13E,15S)-9,11,15-Trihydroxyprosta-5,13-Dien-1-Oic Acid
[CAS# 177020-26-7]

Identification

• Name: (5Z,8beta,9beta,11alpha,13E,15S)-9,11,15-Trihydroxyprosta-5,13-Dien-1-Oic Acid
• Synonyms: " 9β,11α,15S-trihydroxy-(8β)-prosta-5Z,13E-dien-1-oic acid" ; 8-iso Prostaglandin F2?; 8-iso-PGF2β
• Molecular Formula: C₂₀H₃₄O₅
• Molecular Weight: 354.48
• CAS Registry Number: 177020-26-7
• SMILES: O=C(O)CCC/C=C\C[C@@H]1[C@H](O)C[C@@H](O)[C@@H]1/C=C/[C@@H](O)CCCCC
• InChI: 1S/C20H34O5/c1-2-3-6-9-15(21)12-13-17-16(18(22)14-19(17)23)10-7-4-5-8-11-20(24)25/h4,7,12-13,15-19,21-23H,2-3,5-6,8-11,14H2,1H3,(H,24,25)/b7-4-,13-12+/t15-,16-,17+,18+,19+/m0/s1
• InChIKey: PXGPLTODNUVGFL-HMALSPAFSA-N

Properties

• Density: 1.153g/cm³ (Cal.)
• Boiling point: 531°C at 760 mmHg (Cal.)
• Flash point: 289.013°C (Cal.)
• Refractive index: 1.569 (Cal.)