3-O-Rhamnosylchlormadinol Acetate
[CAS# 98753-25-4]

Identification

• Name: 3-O-Rhamnosylchlormadinol Acetate
• Synonyms: [(8R,9S,10R,13S,14S,17R)-17-Acetyl-6-Chloro-10,13-Dimethyl-3-[(2R,3R,4R,5R,6S)-3,4,5-Trihydroxy-6-Methyl-Tetrahydropyran-2-Yl]Oxy-1,2,3,8,9,11,12,14,15,16-Decahydrocyclopenta[A]Phenanthren-17-Yl] Acetate; Acetic Acid [(8R,9S,10R,13S,14S,17R)-17-Acetyl-6-Ch
• Molecular Formula: C₂₉H₄₁ClO₈
• Molecular Weight: 553.09
• CAS Registry Number: 98753-25-4
• SMILES: [C@H]45[C@H]3[C@@H]([C@@]2(C(=CC(O[C@@H]1O[C@H]([C@H](O)[C@@H](O)[C@H]1O)C)CC2)C(=C3)Cl)C)CC[C@@]4([C@](OC(=O)C)(CC5)C(=O)C)C
• InChI: 1S/C29H41ClO8/c1-14-23(33)24(34)25(35)26(36-14)37-17-6-9-27(4)19-7-10-28(5)20(18(19)13-22(30)21(27)12-17)8-11-29(28,15(2)31)38-16(3)32/h12-14,17-20,23-26,33-35H,6-11H2,1-5H3/t14-,17?,18+,19-,20-,23-,24+,25+,26-,27+,28-,29-/m0/s1
• InChIKey: IUZNXPZMINDWNG-AAUVTORYSA-N

Properties

• Density: 1.327g/cm³ (Cal.)
• Boiling point: 672.29°C at 760 mmHg (Cal.)
• Flash point: 360.388°C (Cal.)