Abrusoside A
[CAS# 124962-06-7]

Identification

• Name: Abrusoside A
• Synonyms: C08920
• Molecular Formula: C₃₆H₅₄O₁₀
• Molecular Weight: 646.82
• CAS Registry Number: 124962-06-7
• SMILES: [C@]123[C@]7(C1)[C@@H](CC[C@H]2[C@]4([C@](CC3)(C(CC4)[C@@H]([C@H]5OC(=O)C(=CC5)C)C)C)C)[C@]([C@@H](O[C@@H]6O[C@@H]([C@@H](O)[C@H](O)[C@H]6O)CO)CC7)(C)C(O)=O
• InChI: 1S/C36H54O10/c1-18-6-7-21(44-29(18)41)19(2)20-10-12-33(4)23-8-9-24-34(5,31(42)43)25(46-30-28(40)27(39)26(38)22(16-37)45-30)11-13-35(24)17-36(23,35)15-14-32(20,33)3/h6,19-28,30,37-40H,7-17H2,1-5H3,(H,42,43)/t19-,20?,21-,22+,23-,24-,25-,26+,27-,28+,30-,32+,33-,34-,35+,36-/m0/s1
• InChIKey: CJHYXUPCGHKJOO-OMWWMXIRSA-N

Properties

• Density: 1.337g/cm³ (Cal.)
• Boiling point: 813.59°C at 760 mmHg (Cal.)
• Flash point: 251.903°C (Cal.)