(1R)-1a-Acetyloxy-1,2,3,6,7,7A,10,14,14ab,14b-Decahydro-6a-Hydroxy-3,13-Dimethoxy-5,5,7ab,9,14ba-Pentamethyl-12H-3b,5ab-Epoxy-5H-Furo[3,4-I]Oxepino[4,3-a]Xanthen-12-One
[CAS# 81543-04-6]

Identification

• Name: (1R)-1a-Acetyloxy-1,2,3,6,7,7A,10,14,14ab,14b-Decahydro-6a-Hydroxy-3,13-Dimethoxy-5,5,7ab,9,14ba-Pentamethyl-12H-3b,5ab-Epoxy-5H-Furo[3,4-I]Oxepino[4,3-a]Xanthen-12-One
• Molecular Formula: C₂₈H₃₆O₁₀
• Molecular Weight: 532.59
• CAS Registry Number: 81543-04-6
• SMILES: [C@@]256[C@@]([C@H]1CC4=C(O[C@]1(C[C@H]2O)C)C(=C3COC(C3=C4OC)=O)C)([C@H](OC(=O)C)C[C@](O5)(OC)OC6(C)C)C
• InChI: 1S/C28H36O10/c1-13-16-12-34-23(31)20(16)22(32-7)15-9-17-25(5,36-21(13)15)10-18(30)28-24(3,4)37-27(33-8,38-28)11-19(26(17,28)6)35-14(2)29/h17-19,30H,9-12H2,1-8H3/t17-,18+,19+,25-,26-,27-,28+/m0/s1
• InChIKey: WDGSJYYXVXQQHP-OPQAPENCSA-N

Properties

• Density: 1.368g/cm³ (Cal.)
• Boiling point: 689.797°C at 760 mmHg (Cal.)
• Flash point: 226.449°C (Cal.)