(3aS)-3abeta,5,5a,6,7,9balpha-Hexahydro-6beta-Hydroxy-5aalpha,9-Dimethyl-3-Methylenenaphtho[1,2-b]Furan-2,8(3H,4H)-Dione
[CAS# 27740-15-4]

Identification

• Name: (3aS)-3abeta,5,5a,6,7,9balpha-Hexahydro-6beta-Hydroxy-5aalpha,9-Dimethyl-3-Methylenenaphtho[1,2-b]Furan-2,8(3H,4H)-Dione
• Synonyms: (3As,5Ar,6S,9Bs)-6-Hydroxy-5A,9-Dimethyl-3-Methylene-3A,4,5,6,7,9B-Hexahydrobenzo[G]Benzofuran-2,8-Dione; (3As,5Ar,6S,9Bs)-6-Hydroxy-5A,9-Dimethyl-3-Methylene-3A,4,5,6,7,9B-Hexahydrobenzo[G]Benzofuran-2,8-Quinone; Ludovicin C
• Molecular Formula: C₁₅H₁₈O₄
• Molecular Weight: 262.30
• CAS Registry Number: 27740-15-4
• SMILES: [C@@H]23C1=C(C(C[C@@H]([C@@]1(CC[C@H]2C(=C)C(O3)=O)C)O)=O)C
• InChI: 1S/C15H18O4/c1-7-9-4-5-15(3)11(17)6-10(16)8(2)12(15)13(9)19-14(7)18/h9,11,13,17H,1,4-6H2,2-3H3/t9-,11-,13-,15-/m0/s1
• InChIKey: QPXLDBMZJNDASA-PBLBJHRBSA-N

Properties

• Density: 1.262g/cm³ (Cal.)
• Boiling point: 494.092°C at 760 mmHg (Cal.)
• Flash point: 188.8°C (Cal.)