3beta,5,14-Trihydroxy-19-Acetoxy-5beta-Card-20(22)-Enolide
[CAS# 17162-14-0]

Identification

• Name: 3beta,5,14-Trihydroxy-19-Acetoxy-5beta-Card-20(22)-Enolide
• Synonyms: Acetic Acid [3,5,14-Trihydroxy-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-2,3,4,6,7,8,9,11,12,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-10-Yl]Methyl Ester; Acetic Acid [3,5,14-Trihydroxy-17-(5-Keto-2H-Furan-3-Yl)-13-Methyl-2,3,4,6,7,8,9,11,12,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-10-Yl]Methyl Ester; [3,5,14-Trihydroxy-13-Methyl-17-(5-Oxo-2H-Furan-3-Yl)-2,3,4,6,7,8,9,11,12,15,16,17-Dodecahydro-1H-Cyclopenta[A]Phenanthren-10-Yl]Methyl Ethanoate
• Molecular Formula: C₂₅H₃₆O₇
• Molecular Weight: 448.56
• CAS Registry Number: 17162-14-0
• SMILES: C(OC(=O)C)C45C3C(C1(O)C(C(CC1)C2=CC(OC2)=O)(CC3)C)CCC4(O)CC(O)CC5
• InChI: 1S/C25H36O7/c1-15(26)32-14-23-8-3-17(27)12-24(23,29)9-5-20-19(23)4-7-22(2)18(6-10-25(20,22)30)16-11-21(28)31-13-16/h11,17-20,27,29-30H,3-10,12-14H2,1-2H3
• InChIKey: DEHYARDBGWHJNY-UHFFFAOYSA-N

Properties

• Density: 1.345g/cm³ (Cal.)
• Boiling point: 627.225°C at 760 mmHg (Cal.)
• Flash point: 210.467°C (Cal.)