Analyte Name

Nicodicodine

CAS Number

808-24-2

Molecular Formula

C24 H26 N2 O4

Molecular Weight

406.474

Accurate Mass

406.189

SMILES

COc1ccc2C[C@@H]3[C@@H]4CC[C@H](OC(=O)c5cccnc5)[C@@H]6Oc1c2[C@]46CCN3C

InChI

InChI=1S/C24H26N2O4/c1-26-11-9-24-16-6-8-19(29-23(27)15-4-3-10-25-13-15)22(24)30-21-18(28-2)7-5-14(20(21)24)12-17(16)26/h3-5,7,10,13,16-17,19,22H,6,8-9,11-12H2,1-2H3/t16-,17+,19-,22-,24-/m0/s1

IUPAC

[(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,5,6,7,7a,13-octahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl] pyridine-3-carboxylate

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat