(5Z,11alpha,13E,15S)-11,15-Dihydroxy-15-Methyl-9-Oxo-Prosta-5,13-Dien-1-Oicacid
[CAS# 35700-27-7]

Identification

• Name: (5Z,11alpha,13E,15S)-11,15-Dihydroxy-15-Methyl-9-Oxo-Prosta-5,13-Dien-1-Oicacid
• Synonyms: (Z)-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxy-3-Methyl-Oct-1-Enyl]-5-Oxo-Cyclopentyl]Hept-5-Enoic Acid; (Z)-7-[(1R,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxy-3-Methyl-Oct-1-Enyl]-5-Keto-Cyclopentyl]Hept-5-Enoic Acid; 9-Oxo-11R,15S-Dihydroxy-15-Methyl-5Z,13E-Prostadienoic Acid
• Molecular Formula: C₂₁H₃₄O₅
• Molecular Weight: 366.50
• CAS Registry Number: 35700-27-7
• SMILES: [C@H]1([C@H](C(=O)C[C@H]1O)C\C=C/CCCC(=O)O)\C=C\[C@@](O)(CCCCC)C
• InChI: 1S/C21H34O5/c1-3-4-9-13-21(2,26)14-12-17-16(18(22)15-19(17)23)10-7-5-6-8-11-20(24)25/h5,7,12,14,16-17,19,23,26H,3-4,6,8-11,13,15H2,1-2H3,(H,24,25)/b7-5-,14-12+/t16-,17-,19-,21+/m1/s1
• InChIKey: XSGQFHNPNWBVPT-DSFPJDRCSA-N

Properties

• Density: 1.135g/cm³ (Cal.)
• Boiling point: 535.479°C at 760 mmHg (Cal.)
• Flash point: 291.718°C (Cal.)