(5Z)-7-{(1R,2S)-2-[(3S)-3-Hydroxy-5-Phenyl-1-Penten-1-Yl]-5-Oxo-3-Cyclopenten-1-Yl}-5-Heptenoic Acid
[CAS# 38315-51-4]

Identification

• Name: (5Z)-7-{(1R,2S)-2-[(3S)-3-Hydroxy-5-Phenyl-1-Penten-1-Yl]-5-Oxo-3-Cyclopenten-1-Yl}-5-Heptenoic Acid
• Synonyms: "9-oxo-15S-hydroxy-17-phenyl-18,19,20-trinor-prosta-5Z,10,13E-trien-1-oic acid"; 17-phenyl trinor Prostaglandin A2; 9-oxo-15S-hydroxy-17-phenyl-18,19,20-trinor-prosta-5Z,10,13E-trien-1-oic acid
• Molecular Formula: C₂₃H₂₈O₄
• Molecular Weight: 368.47
• CAS Registry Number: 38315-51-4
• SMILES: C1=CC=C(C=C1)CC[C@@H](C=C[C@H]2C=CC(=O)[C@@H]2C/C=C\CCCC(=O)O)O
• InChI: 1S/C23H28O4/c24-20(15-12-18-8-4-3-5-9-18)16-13-19-14-17-22(25)21(19)10-6-1-2-7-11-23(26)27/h1,3-6,8-9,13-14,16-17,19-21,24H,2,7,10-12,15H2,(H,26,27)/b6-1-,16-13?/t19-,20-,21+/m0/s1
• InChIKey: PBMAXTSZSCARIG-PJBLNIOGSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 583.5±50.0°C at 760 mmHg (Cal.)
• Flash point: 320.8±26.6°C (Cal.)