Cheiranthoside VIII
[CAS# 7044-33-9]

Identification

• Name: Cheiranthoside VIII
• Synonyms: (3S,5S,8R,9S,10S,13R,14S,17R)-3-[(2R,3R,4S,6R)-3,4-Dihydroxy-6-Methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-5,14-Dihydroxy-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]Phenanthrene-10-Carbaldehyde; (3S,5S,8R,9S,10S,13R,14S,17R)-3-[[(2R,3R,4S,6R)-3,4-Dihydroxy-6-Methyl-5-[[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-(Hydroxymethyl)-2-Tetrahydropyranyl]Oxy]-2-Tetrahydropyranyl]Oxy]-5,14-Dihydroxy-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]Phenanthrene-10-Carboxaldehyde; (3S,5S,8R,9S,10S,13R,14S,17R)-3-[(2R,3R,4S,6R)-3,4-Dihydroxy-6-Methyl-5-[(2S,3R,4S,5S,6R)-3,4,5-Trihydroxy-6-Methylol-Tetrahydropyran-2-Yl]Oxy-Tetrahydropyran-2-Yl]Oxy-5,14-Dihydroxy-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]Phenanthrene-10-Carbaldehyde
• Molecular Formula: C₃₅H₅₂O₁₅
• Molecular Weight: 712.79
• CAS Registry Number: 7044-33-9
• SMILES: [C@H]7(O)[C@H](OC1[C@H](O[C@H]([C@@H]([C@@H]1O)O)O[C@H]5CC[C@@]4([C@H]3CC[C@@]2([C@H](CC[C@@]2([C@@H]3CC[C@]4(O)C5)O)C6=CC(OC6)=O)C)C=O)C)O[C@@H]([C@H]([C@@H]7O)O)CO
• InChI: 1S/C35H52O15/c1-16-29(50-31-27(42)25(40)24(39)22(13-36)49-31)26(41)28(43)30(47-16)48-18-3-8-33(15-37)20-4-7-32(2)19(17-11-23(38)46-14-17)6-10-35(32,45)21(20)5-9-34(33,44)12-18/h11,15-16,18-22,24-31,36,39-45H,3-10,12-14H2,1-2H3/t16-,18+,19-,20+,21-,22-,24-,25+,26+,27-,28-,29?,30+,31+,32-,33+,34+,35+/m1/s1
• InChIKey: CAYUJEAJKPLCAV-LPJFSPNFSA-N

Properties

• Density: 1.508g/cm³ (Cal.)
• Boiling point: 927.769°C at 760 mmHg (Cal.)
• Flash point: 288.618°C (Cal.)