Molephantin
[CAS# 50656-66-1]

Identification

• Name: Molephantin
• Synonyms: [(3Ar,4S,6E,9Z,11S,11As)-11-Hydroxy-6,10-Dimethyl-3-Methylene-2,8-Dioxo-4,5,11,11A-Tetrahydro-3Ah-Cyclodeca[B]Furan-4-Yl] 2-Methylprop-2-Enoate; 2-Methylprop-2-Enoic Acid [(3Ar,4S,6E,9Z,11S,11As)-11-Hydroxy-6,10-Dimethyl-3-Methylene-2,8-Dioxo-4,5,11,11A-Tetrahydro-3Ah-Cyclodeca[B]Furan-4-Yl] Ester; 2-Methylacrylic Acid [(3Ar,4S,6E,9Z,11S,11As)-11-Hydroxy-2,8-Diketo-6,10-Dimethyl-3-Methylene-4,5,11,11A-Tetrahydro-3Ah-Cyclodeca[D]Furan-4-Yl] Ester
• Molecular Formula: C₁₉H₂₂O₆
• Molecular Weight: 346.38
• CAS Registry Number: 50656-66-1
• SMILES: [C@@H]12[C@H](C(=C)C(O1)=O)[C@@H](OC(C(=C)C)=O)CC(=C\C(\C=C(/[C@@H]2O)C)=O)\C
• InChI: 1S/C19H22O6/c1-9(2)18(22)24-14-7-10(3)6-13(20)8-11(4)16(21)17-15(14)12(5)19(23)25-17/h6,8,14-17,21H,1,5,7H2,2-4H3/b10-6+,11-8-/t14-,15+,16-,17-/m0/s1
• InChIKey: LXINRHXYVUTAMQ-UKKSPWLWSA-N

Properties

• Density: 1.223g/cm³ (Cal.)
• Boiling point: 550.589°C at 760 mmHg (Cal.)
• Flash point: 196.045°C (Cal.)