Registration Dossier

Reference substances

Reference substances

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General information

Inventory

EC number:
200-969-1
EC name:
Codeine
CAS number:
76-57-3

No inventory information available

Reference substance information

IUPAC name:
3-methoxy-17-methyl-7,8-didehydro-4,5-epoxymorphinan-6-ol
Synonyms
Names:
(-)-codeine
(5alpha,6alpha)- 7,8-didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-ol
Morphinan-6-ol, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, (5alpha,6alpha)-
Morphinan-6alpha-ol, 7,8-didehydro-4,5alpha-epoxy-3-methoxy-17-methyl-, (8CI)
codicept

CAS information

CAS number:
76-57-3

Molecular and structural information

Molecular formula:
C18H21NO3
Molecular weight:
299.364
SMILES notation:
COc1ccc2C[C@@H]3[C@@H]4C=C[C@H](O)[C@@H]5Oc1c2[C@]45CCN3C
InChl:
InChI=1/C18H21NO3/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/h3-6,11-13,17,20H,7-9H2,1-2H3
Structural formula:
Chemical structure