3b-[(2-O-Acetyl-6-Deoxy-3-O-Methyl-a-L-Mannopyranosyl)Oxy]-16b-(Acetyloxy)-14-Hydroxy-5b-Card-20(22)-Enolide
[CAS# 4420-66-0]

Identification

• Name: 3b-[(2-O-Acetyl-6-Deoxy-3-O-Methyl-a-L-Mannopyranosyl)Oxy]-16b-(Acetyloxy)-14-Hydroxy-5b-Card-20(22)-Enolide
• Synonyms: [3-(3-Acetoxy-5-Hydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-14-Hydroxy-10,13-Dimethyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-16-Yl] Acetate; Acetic Acid [3-[(3-Acetoxy-5-Hydroxy-4-Methoxy-6-Methyl-2-Tetrahydropyranyl)Oxy]-14-Hydroxy-10,13-Dimethyl-17-(5-Oxo-2H-Furan-3-Yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-16-Yl] Ester; Acetic Acid [3-(3-Acetoxy-5-Hydroxy-4-Methoxy-6-Methyl-Tetrahydropyran-2-Yl)Oxy-14-Hydroxy-17-(5-Keto-2H-Furan-3-Yl)-10,13-Dimethyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-Tetradecahydrocyclopenta[A]Phenanthren-16-Yl] Ester
• Molecular Formula: C₃₄H₅₀O₁₁
• Molecular Weight: 634.76
• CAS Registry Number: 4420-66-0
• SMILES: CC45C(C3C(C2(CCC(OC1C(C(OC)C(C(O1)C)O)OC(=O)C)CC2CC3)C)CC4)(CC(OC(=O)C)C5C6=CC(=O)OC6)O
• InChI: 1S/C34H50O11/c1-17-28(38)29(40-6)30(44-19(3)36)31(42-17)45-22-9-11-32(4)21(14-22)7-8-24-23(32)10-12-33(5)27(20-13-26(37)41-16-20)25(43-18(2)35)15-34(24,33)39/h13,17,21-25,27-31,38-39H,7-12,14-16H2,1-6H3
• InChIKey: QORPSFATKFHVRW-UHFFFAOYSA-N

Properties

• Density: 1.289g/cm³ (Cal.)
• Boiling point: 723.916°C at 760 mmHg (Cal.)
• Flash point: 222.259°C (Cal.)