Analyte Name

Polyphyllin II

CAS Number

76296-72-5

Molecular Formula

C44H70O16

Molecular Weight

855.02

Accurate Mass

854.47

SMILES

OCC(C(OC1OC(CO)C(O)C1O)C(OC2OC(C)C(O)C(O)C2O)C3O)OC3OC(C4)CCC5(C)C4=CCC6C5CCC7(C)C6CC8C7C(C)C9(OCC(C)CC9)O8

InChI

InChI=1S/C44H70O16/c1-19-8-13-44(53-18-19)20(2)30-27(60-44)15-26-24-7-6-22-14-23(9-11-42(22,4)25(24)10-12-43(26,30)5)55-41-36(52)38(59-39-35(51)33(49)31(47)21(3)54-39)37(29(17-46)57-41)58-40-34(50)32(48)28(16-45)56-40/h6,19-21,23-41,45-52H,7-18H2,1-5H3

IUPAC

2-((3-((3,4-dihydroxy-5-(hydroxymethyl)tetrahydrofuran-2-yl)oxy)-5-hydroxy-2-(hydroxymethyl)-6-((5',6a,8a,9-tetramethyl-1,3,3',4,4',5,5',6,6a,6b,6',7,8,8a,8b,9,11a,12,12a,12b-icosahydrospiro[naphtho[2',1':4,5]indeno[2,1-b]furan-10,2'-pyran]-4-yl)oxy)tetrahydro-2H-pyran-4-yl)oxy)-6-methyltetrahydro-2H-pyran-3,4,5-triol

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat