Analyte Name

Vernodalol

CAS Number

65388-17-2

Molecular Formula

C20H24O8

Molecular Weight

392.4

Accurate Mass

392.15

SMILES

C(=C)[C@@]12[C@@]([C@@H](O)[C@H](C(C(OC)=O)=C)[C@@H](OC(C(CO)=C)=O)C1)(C(=C)C(=O)OC2)[H]

InChI

InChI=1S/C20H24O8/c1-6-20-7-13(28-17(23)10(2)8-21)14(11(3)18(24)26-5)16(22)15(20)12(4)19(25)27-9-20/h6,13-16,21-22H,1-4,7-9H2,5H3/t13-,14+,15+,16-,20+/m0/s1

IUPAC

(4aR,5R,6S,7S,8aR)-5-hydroxy-6-(3-methoxy-3-oxoprop-1-en-2-yl)-4-methylene-3-oxo-8a-vinyloctahydro-1H-isochromen-7-yl 2-(hydroxymethyl)acrylate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat