Deacetyldihydrogedunin
[CAS# 10314-91-7]

Identification

• Name: Deacetyldihydrogedunin
• Synonyms: 16,17-Seco-24-Nor-5.Alpha.,13.Alpha.,14.Beta.,17.Alpha.-Chola-20,22-Dien-16-Oic Acid, 14,15.Beta.:21,23-Diepoxy-7.Alpha.,17-Dihydroxy-4,4,8-Trimethyl-3-Oxo-, 16,17-Lactone; D-Homo-24-Nor-17-Oxachola-20,22-Diene-3,16-Dione, 14,15:21,23-Diepoxy-7-Hydroxy-4,4,8-Trimethyl-, (5.Alpha.,7.Alpha.,13.Alpha.,14.Beta.,15.Beta.,17A.Alpha.)-; Deacetyldihydrogedunin
• Molecular Formula: C₂₆H₃₄O₆
• Molecular Weight: 442.55
• CAS Registry Number: 10314-91-7
• SMILES: C1=CC(=CO1)C5C4(C)C6(C3(C(C2(CCC(=O)C(C)(C2CC3O)C)C)CC4)C)C(C(=O)O5)O6
• InChI: 1S/C26H34O6/c1-22(2)16-12-18(28)25(5)15(23(16,3)9-7-17(22)27)6-10-24(4)19(14-8-11-30-13-14)31-21(29)20-26(24,25)32-20/h8,11,13,15-16,18-20,28H,6-7,9-10,12H2,1-5H3
• InChIKey: WDUBDMHNLXNHDG-UHFFFAOYSA-N

Properties

• Density: 1.281g/cm³ (Cal.)
• Boiling point: 588.048°C at 760 mmHg (Cal.)
• Flash point: 309.44°C (Cal.)