(11alpha,13E,15S)-11,15-Dihydroxy-15-Methyl-9-Oxo-Prost-13-En-1-Oic Acid
[CAS# 35700-26-6]

Identification

• Name: (11alpha,13E,15S)-11,15-Dihydroxy-15-Methyl-9-Oxo-Prost-13-En-1-Oic Acid
• Synonyms: 7-[(1R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxy-3-Methyl-Oct-1-Enyl]-5-Oxo-Cyclopentyl]Heptanoic Acid; 7-[(1R,3R)-3-Hydroxy-2-[(E,3S)-3-Hydroxy-3-Methyl-Oct-1-Enyl]-5-Keto-Cyclopentyl]Enanthic Acid; 15(S)-15-Methylprostaglandin E1
• Molecular Formula: C₂₁H₃₆O₅
• Molecular Weight: 368.51
• CAS Registry Number: 35700-26-6
• SMILES: [C@H]1(C([C@H](O)CC1=O)\C=C\[C@@](O)(CCCCC)C)CCCCCCC(=O)O
• InChI: 1S/C21H36O5/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/h12,14,16-17,19,23,26H,3-11,13,15H2,1-2H3,(H,24,25)/b14-12+/t16-,17?,19-,21+/m1/s1
• InChIKey: OMNFCPCBKCERJP-JGEGBOILSA-N

Properties

• Density: 1.119g/cm³ (Cal.)
• Boiling point: 534.917°C at 760 mmHg (Cal.)
• Flash point: 291.379°C (Cal.)