Methyl (4R,5E,7E,12alpha,14Z)-4,12-diacetoxy-9-oxoprosta-5,7,10,14-tetraen-1-oate
[CAS# 85700-43-2]

Identification

• Name: Methyl (4R,5E,7E,12alpha,14Z)-4,12-diacetoxy-9-oxoprosta-5,7,10,14-tetraen-1-oate
• Synonyms: methyl (4R,5E,7E,12α,14Z)-4,12-bis(acetyloxy)-9-oxoprosta-5,7,10,14-tetraen-1-oate; methyl (4R,5E,7E,14Z)-4,12-bis(acetyloxy)-9-oxo-12α-prosta-5,7,10,14-tetraen-1-oate; methyl 4R,12S-diacetoxy-9-oxo-5E,7E,10Z,13Z-prostatetraenoate-cyclo[8,12]
• Molecular Formula: C₂₅H₃₄O₇
• Molecular Weight: 446.53
• CAS Registry Number: 85700-43-2
• SMILES: O=C/1/C=C\[C@](C/C=C\CCCCC)(OC(C)=O)C\1=C\C=C\[C@@H](CCC(=O)OC)OC(C)=O
• InChI: 1S/C25H34O7/c1-5-6-7-8-9-10-17-25(32-20(3)27)18-16-23(28)22(25)13-11-12-21(31-19(2)26)14-15-24(29)30-4/h9-13,16,18,21H,5-8,14-15,17H2,1-4H3/b10-9-,12-11+,22-13-/t21-,25-/m0/s1
• InChIKey: QXSYLWTUKSQQCP-VZCZYXORSA-N

Properties

• Density: 1.118g/cm³ (Cal.)
• Boiling point: 556.632°C at 760 mmHg (Cal.)
• Flash point: 236.188°C (Cal.)