MARRUBIIN(AS)

Analyte Name

Marrubiin

CAS Number

465-92-9

Molecular Formula

C20 H28 O4

Molecular Weight

332.43

Accurate Mass

332.1988

SMILES

C[C@@H]1C[C@H]2OC(=O)[C@@]3(C)CCC[C@@](C)([C@@H]23)[C@@]1(O)CCc4cocc4

InChI

InChI=1S/C20H28O4/c1-13-11-15-16-18(2,17(21)24-15)7-4-8-19(16,3)20(13,22)9-5-14-6-10-23-12-14/h6,10,12-13,15-16,22H,4-5,7-9,11H2,1-3H3/t13-,15-,16+,18+,19+,20-/m1/s1

Storage Temperature

+4°C

Shipping Temperature

Room Temperature

Country of Origin

UNITED STATES

Product Format

Single Solution