Analyte Name

Ligustroside Aglycone

CAS Number

174511-64-9

Molecular Formula

C19 H22 O7

Molecular Weight

362.37

Accurate Mass

362.1366

SMILES

COC(=O)C1=CO[C@@H](O)\C(=C\C)\[C@@H]1CC(=O)OCCc2ccc(O)cc2

InChI

InChI=1S/C19H22O7/c1-3-14-15(16(18(22)24-2)11-26-19(14)23)10-17(21)25-9-8-12-4-6-13(20)7-5-12/h3-7,11,15,19-20,23H,8-10H2,1-2H3/b14-3+/t15-,19+/m0/s1

IUPAC

(2R,3E,4S)-3-Ethylidene-3,4-dihydro-2-hydroxy-5-(methoxycarbonyl)-2H-pyran-4-acetic Acid 2-(4-Hydroxyphenyl)ethyl Ester

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat