(Z)-2-Methyl-2-Butenoic Acid [(R,E)-5-Hydroxy-3-Methyl-1-[(2R,3R)-Tetrahydro-2-[(E)-3-Hydroxy-2-Methyl-1-Propenyl]-4-Methylene-5-Oxofuran-3-Yl]-3-Pentenyl] Ester
[CAS# 55306-05-3]

Identification

• Name: (Z)-2-Methyl-2-Butenoic Acid [(R,E)-5-Hydroxy-3-Methyl-1-[(2R,3R)-Tetrahydro-2-[(E)-3-Hydroxy-2-Methyl-1-Propenyl]-4-Methylene-5-Oxofuran-3-Yl]-3-Pentenyl] Ester
• Synonyms: [(E,1R)-5-Hydroxy-1-[(2R,3R)-2-[(E)-3-Hydroxy-2-Methyl-Prop-1-Enyl]-4-Methylene-5-Oxo-Tetrahydrofuran-3-Yl]-3-Methyl-Pent-3-Enyl] (Z)-2-Methylbut-2-Enoate; (Z)-2-Methylbut-2-Enoic Acid [(E,1R)-5-Hydroxy-1-[(2R,3R)-2-[(E)-3-Hydroxy-2-Methylprop-1-Enyl]-4-Methylene-5-Oxo-3-Tetrahydrofuranyl]-3-Methylpent-3-Enyl] Ester; (Z)-2-Methylbut-2-Enoic Acid [(E,1R)-5-Hydroxy-1-[(2R,3R)-2-[(E)-3-Hydroxy-2-Methyl-Prop-1-Enyl]-5-Keto-4-Methylene-Tetrahydrofuran-3-Yl]-3-Methyl-Pent-3-Enyl] Ester
• Molecular Formula: C₂₀H₂₈O₆
• Molecular Weight: 364.44
• CAS Registry Number: 55306-05-3
• SMILES: [C@@H]1(C(C(O[C@@H]1/C=C(/CO)C)=O)=C)[C@H](OC(C(=C/C)\C)=O)C/C(=C/CO)C
• InChI: 1S/C20H28O6/c1-6-14(4)19(23)25-16(9-12(2)7-8-21)18-15(5)20(24)26-17(18)10-13(3)11-22/h6-7,10,16-18,21-22H,5,8-9,11H2,1-4H3/b12-7+,13-10+,14-6-/t16-,17-,18-/m1/s1
• InChIKey: GHEIESSKOYFMTB-XSBMVCGPSA-N

Properties

• Density: 1.153g/cm³ (Cal.)
• Boiling point: 559.032°C at 760 mmHg (Cal.)
• Flash point: 193.012°C (Cal.)