Codeine 6-beta-D-Glucuronide 1.0 mg/ml in Water

Analyte Name

Codeine-6-beta-D-glucuronide

CAS Number

20736-11-2

Molecular Formula

C24 H29 N O9

Molecular Weight

475.49

Accurate Mass

475.1842

Appearance/Form

Liquid

Color

Colourless

Odor

Odourless

SMILES

COc1ccc2C[C@@H]3[C@@H]4C=C[C@H](O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O)[C@@H]6Oc1c2[C@]46CCN3C

InChI

InChI=1S/C24H29NO9/c1-25-8-7-24-11-4-6-14(32-23-18(28)16(26)17(27)20(34-23)22(29)30)21(24)33-19-13(31-2)5-3-10(15(19)24)9-12(11)25/h3-6,11-12,14,16-18,20-21,23,26-28H,7-9H2,1-2H3,(H,29,30)/t11-,12+,14-,16-,17-,18+,20-,21-,23+,24-/m0/s1

IUPAC

(2S,3S,4S,5R,6R)-6-[[(4R,4aR,7S,7aR,12bS)-9-methoxy-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

Storage Temperature

+5°C

Shipping Temperature

Room Temperature

Country of Origin

GERMANY

Tariff Code

29391900

Product Type

Metabolite

Product Format

Single Solution

Matrix

Water