(Z)-7-[(1R,2R,3E,5S)-5-Hydroxy-2-[(E,3R)-3-Hydroxyoct-1-Enyl]-3-Methoxyiminocyclopentyl]Hept-5-Enoic Acid
[CAS# 130377-58-1]

Identification

• Name: (Z)-7-[(1R,2R,3E,5S)-5-Hydroxy-2-[(E,3R)-3-Hydroxyoct-1-Enyl]-3-Methoxyiminocyclopentyl]Hept-5-Enoic Acid
• Synonyms: (Z)-7-[(1R,2R,3E,5S)-5-Hydroxy-2-[(E,3R)-3-Hydroxyoct-1-Enyl]-3-Methoxyimino-Cyclopentyl]Hept-5-Enoic Acid; 11-Methoxime Prostaglandin D2; 11-Methoxime-Pgd2
• Molecular Formula: C₂₁H₃₅NO₅
• Molecular Weight: 381.51
• CAS Registry Number: 130377-58-1
• SMILES: [C@H]/1([C@H]([C@@H](O)CC1=N/OC)C\C=C/CCCC(=O)O)\C=C\[C@H](O)CCCCC
• InChI: 1S/C21H35NO5/c1-3-4-7-10-16(23)13-14-17-18(20(24)15-19(17)22-27-2)11-8-5-6-9-12-21(25)26/h5,8,13-14,16-18,20,23-24H,3-4,6-7,9-12,15H2,1-2H3,(H,25,26)/b8-5-,14-13+,22-19+/t16-,17-,18-,20+/m1/s1
• InChIKey: VXJIIKLPNMQQQE-GVUJQGKDSA-N

Properties

• Density: 1.12g/cm³ (Cal.)
• Boiling point: 556.304°C at 760 mmHg (Cal.)
• Flash point: 290.242°C (Cal.)