Analyte Name

16-COOH Mitragynine-D3

Molecular Formula

C22 D3 H25 N2 O4

Molecular Weight

387.487

Accurate Mass

387.224

SMILES

[2H]C([2H])([2H])Oc1cccc2[nH]c3[C@@H]4C[C@@H]([C@H](CC)CN4CCc3c12)\C(=C/OC)\C(=O)O

InChI

InChI=1S/C22H28N2O4/c1-4-13-11-24-9-8-14-20-17(6-5-7-19(20)28-3)23-21(14)18(24)10-15(13)16(12-27-2)22(25)26/h5-7,12-13,15,18,23H,4,8-11H2,1-3H3,(H,25,26)/b16-12+/t13-,15+,18+/m1/s1/i3D3

IUPAC

(E)-2-[(2S,3S,12bS)-3-ethyl-8-(trideuteriomethoxy)-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-2-yl]-3-methoxyprop-2-enoic acid

SIL Type

Deuterium

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat