Clinoposaponin X
[CAS# 159122-00-6]

Identification

• Name: Clinoposaponin X
• Synonyms: 13,28-Epoxy-16(Beta),23-Dihydroxyolean-11-En-3-Yl-Beta-Glucopyranosyl-1-6-Glucopyranoside; Clinoposaponin X; Saikogenin F 3-Bentiobioside
• Molecular Formula: C₄₂H₆₈O₁₄
• Molecular Weight: 796.99
• CAS Registry Number: 159122-00-6
• SMILES: [C@@H]18C27OCC1([C@H](O)C[C@]2([C@]3(C([C@@]6(C(CC3)C(C(O[C@@H]4O[C@@H]([C@@H](O)[C@H](O)[C@H]4O)CO[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)CO)CC6)(CO)C)C)C=C7)C)C)CCC(C8)(C)C
• InChI: 1S/C42H68O14/c1-36(2)13-14-41-20-53-42(25(41)15-36)12-8-24-37(3)10-9-27(38(4,19-44)23(37)7-11-39(24,5)40(42,6)16-26(41)45)56-35-33(51)31(49)29(47)22(55-35)18-52-34-32(50)30(48)28(46)21(17-43)54-34/h8,12,21-35,43-51H,7,9-11,13-20H2,1-6H3/t21-,22-,23?,24?,25+,26-,27?,28-,29-,30+,31+,32-,33-,34-,35+,37+,38?,39-,40+,41?,42?/m1/s1
• InChIKey: ACWRMVMYIHRKJI-RAWUFCCHSA-N

Properties

• Density: 1.395g/cm³ (Cal.)
• Boiling point: 913.969°C at 760 mmHg (Cal.)
• Flash point: 506.55°C (Cal.)