2-Methylpropanoic Acid [1a,2,6,6a,7,8,9a,10-Octahydro-11-Hydroxy-7-Methylene-8-Oxo-3H-4,10alpha-(Methanoxymethano)Oxireno[8,9]Cyclodeca[1,2-b]Furan-6-Yl] Ester
[CAS# 21871-14-7]

Identification

• Name: 2-Methylpropanoic Acid [1a,2,6,6a,7,8,9a,10-Octahydro-11-Hydroxy-7-Methylene-8-Oxo-3H-4,10alpha-(Methanoxymethano)Oxireno[8,9]Cyclodeca[1,2-b]Furan-6-Yl] Ester
• Synonyms: Vernomygdin
• Molecular Formula: C₁₉H₂₄O₇
• Molecular Weight: 364.39
• CAS Registry Number: 21871-14-7
• SMILES: [C@]134O[C@@H]1CC\C(=C\[C@H]2OC(=O)C([C@@H]2[C@@H](OC(=O)C(C)C)C3)=C)CO[C@H]4O
• InChI: 1S/C19H24O7/c1-9(2)16(20)25-13-7-19-14(26-19)5-4-11(8-23-18(19)22)6-12-15(13)10(3)17(21)24-12/h6,9,12-15,18,22H,3-5,7-8H2,1-2H3/b11-6-/t12-,13+,14-,15+,18-,19-/m1/s1
• InChIKey: XFUPYBHPEVBTJS-ULYHCOEVSA-N

Properties

• Density: 1.329g/cm³ (Cal.)
• Boiling point: 584.002°C at 760 mmHg (Cal.)
• Flash point: 210.102°C (Cal.)