7-Oxo-15-Methylprostaglandin E1 Methyl Ester
[CAS# 68538-80-7]

Identification

• Name: 7-Oxo-15-Methylprostaglandin E1 Methyl Ester
• Synonyms: Methyl 7-[(1S,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxy-3-Methyl-Oct-1-Enyl]-5-Oxo-Cyclopentyl]-7-Oxo-Heptanoate; 7-[(1S,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxy-3-Methyloct-1-Enyl]-5-Oxocyclopentyl]-7-Oxoheptanoic Acid Methyl Ester; 7-[(1S,2R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxy-3-Methyl-Oct-1-Enyl]-5-Keto-Cyclopentyl]-7-Keto-Enanthic Acid Methyl Ester
• Molecular Formula: C₂₂H₃₆O₆
• Molecular Weight: 396.52
• CAS Registry Number: 68538-80-7
• SMILES: [C@H]1(C(CCCCCC(=O)OC)=O)C(C[C@H]([C@@H]1\C=C\[C@@](CCCCC)(C)O)O)=O
• InChI: 1S/C22H36O6/c1-4-5-9-13-22(2,27)14-12-16-18(24)15-19(25)21(16)17(23)10-7-6-8-11-20(26)28-3/h12,14,16,18,21,24,27H,4-11,13,15H2,1-3H3/b14-12+/t16-,18+,21-,22-/m0/s1
• InChIKey: LIYHLZUWUHRRRD-JONZWKOESA-N

Properties

• Density: 1.138g/cm³ (Cal.)
• Boiling point: 538.466°C at 760 mmHg (Cal.)
• Flash point: 177.024°C (Cal.)