Analyte Name

Codeine citrate

CAS Number

5913-73-5

Molecular Formula

C24H29NO10

Molecular Weight

491.49

Accurate Mass

491.18

SMILES

OC(C(O)=O)(CC(O)=O)CC(O)=O.O[C@@H]1[C@H]2[C@]34C5=C(C=CC(OC)=C5O2)C[C@@H](N(CC4)C)[C@]3([H])C=C1

InChI

InChI=1S/C18H21NO3.C6H8O7/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-6,11-13,17,20H,7-9H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t11-,12+,13-,17-,18-;/m0./s1

IUPAC

(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,3,4,4a,7,7a-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinolin-7-ol 2-hydroxypropane-1,2,3-tricarboxylate

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Bioactive small molecule

Product Format

Neat

API Family

Codeine

Analytical Method

HPLC