6-Hydroxyspirostan-3-yl hexopyranosyl-(1->2)-[hexopyranosyl-(1->3)]hexopyranosyl-(1->4)hexopyranoside
[CAS# 72994-87-7]

Identification

• Name: 6-Hydroxyspirostan-3-yl hexopyranosyl-(1->2)-[hexopyranosyl-(1->3)]hexopyranosyl-(1->4)hexopyranoside
• Synonyms: Isoeruboside B; Iso-eruboside B
• Molecular Formula: C₅₁H₈₄O₂₄
• Molecular Weight: 1081.20
• CAS Registry Number: 72994-87-7
• SMILES: OC%10C(O)C(O)C(OC%10OC9C(OC1OC(CO)C(O)C(O)C1O)C(O)C(OC9OC2C(O)C(O)C(OC2CO)OC7CC8C(O)CC5C(CCC6(C4C(OC3(OCC(CC3)C)C4C)CC56)C)C8(C)CC7)CO)CO
• InChI: 1S/C51H84O24/c1-19-5-10-51(66-18-19)20(2)32-27(75-51)13-24-22-12-26(56)25-11-21(6-8-49(25,3)23(22)7-9-50(24,32)4)67-45-41(65)38(62)42(31(17-55)71-45)72-48-44(74-47-40(64)37(61)34(58)29(15-53)69-47)43(35(59)30(16-54)70-48)73-46-39(63)36(60)33(57)28(14-52)68-46/h19-48,52-65H,5-18H2,1-4H3
• InChIKey: ZQEKBPUAGJKEQO-UHFFFAOYSA-N

Properties

• Density: 1.531g/cm³ (Cal.)