Analyte Name

3-O-beta-D-Glucopyranosyl Alternariol-9-methyl Ether

CAS Number

1422465-59-5

Molecular Formula

C21 H22 O10

Molecular Weight

434.393

Accurate Mass

434.121

SMILES

COc1cc(O)c2C(=O)Oc3cc(O[C@@H]4OC(CO)C(O)C(O)C4O)cc(C)c3c2c1

InChI

InChI=1S/C21H22O10/c1-8-3-10(29-21-19(26)18(25)17(24)14(7-22)31-21)6-13-15(8)11-4-9(28-2)5-12(23)16(11)20(27)30-13/h3-6,14,17-19,21-26H,7H2,1-2H3/t14?,17?,18?,19?,21-/m1/s1

IUPAC

7-hydroxy-9-methoxy-1-methyl-3-[(2S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybenzo[c]chromen-6-one

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Contaminant

Product Format

Neat