(1S)-1beta-[(beta-D-Altropyranosyloxy)Methyl]-7alpha-Vinyl-3,4,4a,4balpha,5,6,7,8,10,10aalpha-Decahydro-1,4abeta,7-Trimethylphenanthren-2(1H)-One
[CAS# 29478-41-9]

Identification

• Name: (1S)-1beta-[(beta-D-Altropyranosyloxy)Methyl]-7alpha-Vinyl-3,4,4a,4balpha,5,6,7,8,10,10aalpha-Decahydro-1,4abeta,7-Trimethylphenanthren-2(1H)-One
• Synonyms: 1,4A,7-Trimethyl-1-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxymethyl]-7-Vinyl-3,4,4B,5,6,8,10,10A-Octahydrophenanthren-2-One; 1,4A,7-Trimethyl-1-[[3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxymethyl]-7-Vinyl-3,4,4B,5,6,8,10,10A-Octahydrophenanthren-2-One; 1,4A,7-Trimethyl-1-[(3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl)Oxymethyl]-7-Vinyl-3,4,4B,5,6,8,10,10A-Octahydrophenanthren-2-One
• Molecular Formula: C₂₆H₄₀O₇
• Molecular Weight: 464.60
• CAS Registry Number: 29478-41-9
• SMILES: C(C3(C1C(C2C(=CC1)CC(CC2)(C=C)C)(CCC3=O)C)C)OC4C(C(O)C(C(O4)CO)O)O
• InChI: 1S/C26H40O7/c1-5-24(2)10-8-16-15(12-24)6-7-18-25(16,3)11-9-19(28)26(18,4)14-32-23-22(31)21(30)20(29)17(13-27)33-23/h5-6,16-18,20-23,27,29-31H,1,7-14H2,2-4H3
• InChIKey: HQWFRECCMSDSQZ-UHFFFAOYSA-N

Properties

• Density: 1.25g/cm³ (Cal.)
• Boiling point: 621.81°C at 760 mmHg (Cal.)
• Flash point: 203.481°C (Cal.)