16-Acetoxy-3-[(2,6-Dideoxy-3-O-Methylhexopyranosyl)Oxy]-14-Hydroxycard-20(22)-Enolide
[CAS# 31087-94-2]

Identification

• Name: 16-Acetoxy-3-[(2,6-Dideoxy-3-O-Methylhexopyranosyl)Oxy]-14-Hydroxycard-20(22)-Enolide
• Synonyms: Beauwalloside; Hongheloside A; NSC 95089
• Molecular Formula: C₃₂H₄₈O₉
• Molecular Weight: 576.72
• CAS Registry Number: 31087-94-2
• SMILES: O=C\1OC/C(=C/1)C2C(OC(=O)C)CC6(O)C2(C)CCC5C6CCC4CC(OC3OC(C(O)C(OC)C3)C)CCC45C
• InChI: 1S/C32H48O9/c1-17-29(35)24(37-5)14-27(39-17)41-21-8-10-30(3)20(13-21)6-7-23-22(30)9-11-31(4)28(19-12-26(34)38-16-19)25(40-18(2)33)15-32(23,31)36/h12,17,20-25,27-29,35-36H,6-11,13-16H2,1-5H3
• InChIKey: JLPDBLFIVFSOCC-UHFFFAOYSA-N

Properties

• Density: 1.261g/cm³ (Cal.)
• Boiling point: 693.669°C at 760 mmHg (Cal.)
• Flash point: 217.166°C (Cal.)