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morphinone

MNXM732895 is deprecated and replaced by MNXM732894

Properties

Image

Occurences in reactions

MNX_ID

MNXM732894

	#reac
in my sandbox	0
in MNXref (generic)	5
in models (compartimentalized)	0

formula

C₁₇H₁₈NO₃

charge

mass

284.12812

reference

InChIKey

PFBSOANQDDTNGJ-YNHQPCIGSA-O

InChI

InChI=1S/C17H17NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,16,19H,6-8H2,1H3/p+1/t10-,11+,16-,17-/m0/s1

SMILES

C[NH+]1CC[C@]23c4c5ccc(O)c4O[C@H]2C(=O)C=C[C@H]3[C@H]1C5

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:57728 chebi:57728	morphinone 3-hydroxy-17-methyl-7,8-didehydro-4,5-epoxy-5alpha-morphinan-17-ium-6-one morphiniumone cation morphiniumone(1+) morphinone cation
sabiork.compound:5761 sabiorkM:5761 kegg.compound:C01735 keggC:C01735	Morphinone
hmdb:HMDB0003563	Morphinone (1S,5R,13R,17R)-10-hydroxy-4-methyl-12-oxa-4-azapentacyclo[9.6.1.0¹,¹³.0⁵,¹⁷.0⁷,¹⁸]octadeca-7(18),8,10,15-tetraen-14-one Didehydro-4,5-a-epoxy-3-hydroxy-17-methylmorphinan-6-one Didehydro-4,5-alpha-epoxy-3-hydroxy-17-methylmorphinan-6-one morphinone
seed.compound:cpd01196 seedM:cpd01196	Morphinone morphinone
metacyc.compound:MORPHINONE metacycM:MORPHINONE	morphinone
CHEBI:16315 chebi:16315	morphinone 3-hydroxy-17-methyl-7,8-didehydro-4,5-epoxy-5alpha-morphinan-6-one Didehydro-4,5-alpha-epoxy-3-hydroxy-17-methylmorphinan-6-one Morphinone
hmdb:HMDB03563 chebi:14623 chebi:25420 chebi:7004 keggC:M_C01735 seedM:M_cpd01196	secondary/obsolete/fantasy identifier