(8xi,13E)-11,15-Dihydroxy-16,16-dimethyl-6,9-dioxoprost-13-en-1-oic acid
[CAS# 75874-32-7]

Identification

• Name: (8xi,13E)-11,15-Dihydroxy-16,16-dimethyl-6,9-dioxoprost-13-en-1-oic acid
• Synonyms: "16,16-dimethyl-6-keto Prostaglandin E1"; " 6,9-dioxo-11α,15R-dihydroxy-16,16-dimethyl-prost-13E-en-1-oic acid"
• Molecular Formula: C₂₂H₃₆O₆
• Molecular Weight: 396.52
• CAS Registry Number: 75874-32-7
• SMILES: CCCCC(C)(C)C(C=CC1C(CC(=O)C1CC(=O)CCCCC(=O)O)O)O
• InChI: 1S/C22H36O6/c1-4-5-12-22(2,3)20(26)11-10-16-17(19(25)14-18(16)24)13-15(23)8-6-7-9-21(27)28/h10-11,16-18,20,24,26H,4-9,12-14H2,1-3H3,(H,27,28)/b11-10+/t16-,17?,18?,20?/m1/s1
• InChIKey: BWEWJWWBXZXMHO-JVOZGECNSA-N

Properties

• Density: 1.155g/cm³ (Cal.)
• Boiling point: 586.664°C at 760 mmHg (Cal.)
• Flash point: 322.64°C (Cal.)