CAS Registry Number®
467-13-0
CAS Name
Codeinone
Molecular Formula
C18H19NO3
Molecular Mass
297.35
Compound Properties
-
Melting Point (1)
181.5-182.5 °C
Source(s)
- (1) Findlay, Stephen P.; Journal of the American Chemical Society, (1950), 72, 3247-9, CAplus
Other Names and Identifiers
InChI
InChI=1S/C18H19NO3/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/h3-6,11-12,17H,7-9H2,1-2H3/t11-,12+,17-,18-/m0/s1
InChIKey
InChIKey=XYYVYLMBEZUESM-CMKMFDCUSA-N
SMILES
O=C1[C@]2([C@]34C=5C(O2)=C(OC)C=CC5C[C@]([C@@]3(C=C1)[H])(N(C)CC4)[H])[H]
Canonical SMILES
O=C1C=CC2C3N(C)CCC42C5=C(OC14)C(OC)=CC=C5C3
Other Names for this Substance
- Morphinan-6-one, 7,8-didehydro-4,5-epoxy-3-methoxy-17-methyl-, (5α)-
- Morphinan-6-one, 7,8-didehydro-4,5α-epoxy-3-methoxy-17-methyl-
- Codeinone
- (5α)-7,8-Didehydro-4,5-epoxy-3-methoxy-17-methylmorphinan-6-one
- (-)-Codeinone
- 6-Oxocodeine
