(1R*,2S*,4S*(S*),5R*,10R*,12S*,14R*,15R*)-(-)-2,5-Bis(Acetyloxy)-7,12-Dimethyl-4-(2-Methyloxiranyl)-11,16,18,19-Tetraoxapentacyclo(12.2.2.1(6,9).0(1,15).0(10.12))Nonadeca-6,8-Dien-17-One
[CAS# 123483-20-5]

Identification

• Name: (1R*,2S*,4S*(S*),5R*,10R*,12S*,14R*,15R*)-(-)-2,5-Bis(Acetyloxy)-7,12-Dimethyl-4-(2-Methyloxiranyl)-11,16,18,19-Tetraoxapentacyclo(12.2.2.1(6,9).0(1,15).0(10.12))Nonadeca-6,8-Dien-17-One
• Synonyms: Bipinnatin C; Bipinnatin-C
• Molecular Formula: C₂₄H₂₈O₁₀
• Molecular Weight: 476.48
• CAS Registry Number: 123483-20-5
• SMILES: O1C4=CC(=C1[C@H](OC(=O)C)C(C[C@H](OC(=O)C)C23O[C@@H]2[C@H](OC3=O)C[C@@]5(O[C@@H]45)C)C6(OC6)C)C
• InChI: 1S/C24H28O10/c1-10-6-14-19-22(4,33-19)8-15-20-24(34-20,21(27)32-15)16(29-11(2)25)7-13(23(5)9-28-23)18(17(10)31-14)30-12(3)26/h6,13,15-16,18-20H,7-9H2,1-5H3/t13?,15-,16+,18-,19+,20-,22+,23?,24?/m1/s1
• InChIKey: FXDXTJXKPXLNSW-VYWOMTIUSA-N

Properties

• Density: 1.419g/cm³ (Cal.)
• Boiling point: 606.537°C at 760 mmHg (Cal.)
• Flash point: 320.622°C (Cal.)