Methyl (Z)-7-[(1R,2R,5S)-5-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-3-Oxocyclopentyl]Hept-5-Enoate
[CAS# 49852-81-5]

Identification

• Name: Methyl (Z)-7-[(1R,2R,5S)-5-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-3-Oxocyclopentyl]Hept-5-Enoate
• Synonyms: Methyl (Z)-7-[(1R,2R,5S)-5-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-3-Oxo-Cyclopentyl]Hept-5-Enoate; (Z)-7-[(1R,2R,5S)-5-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-3-Oxocyclopentyl]Hept-5-Enoic Acid Methyl Ester; (Z)-7-[(1R,2R,5S)-5-Hydroxy-2-[(E,3S)-3-Hydroxyoct-1-Enyl]-3-Keto-Cyclopentyl]Hept-5-Enoic Acid Methyl Ester
• Molecular Formula: C₂₁H₃₄O₅
• Molecular Weight: 366.50
• CAS Registry Number: 49852-81-5
• SMILES: [C@@H]1(\C=C\[C@H](CCCCC)O)[C@@H](C\C=C/CCCC(OC)=O)[C@H](CC1=O)O
• InChI: 1S/C21H34O5/c1-3-4-7-10-16(22)13-14-18-17(19(23)15-20(18)24)11-8-5-6-9-12-21(25)26-2/h5,8,13-14,16-19,22-23H,3-4,6-7,9-12,15H2,1-2H3/b8-5-,14-13+/t16-,17+,18+,19-/m0/s1
• InChIKey: WNBMQMMGBBWUOZ-BYNKDMOPSA-N

Properties

• Density: 1.103g/cm³ (Cal.)
• Boiling point: 509.981°C at 760 mmHg (Cal.)
• Flash point: 169.404°C (Cal.)