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neopinone

PropertiesImageOccurences in reactions
MNX_IDMNXM2268Image of MNXM2268
#reac
in my sandbox 0
in MNXref (generic)3
in models (compartimentalized) 0
formulaC18H20NO3
charge1
mass298.35634
referencechebi:59950
InChIKeyLJVKMVSYTWPNGA-UUWFMWQGSA-O
InChIInChI=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/h3-4,6,12,17H,5,7-9H2,1-2H3/p+1/t12-,17+,18+/m1/s1
SMILESCOc1ccc2C[C@H]3[NH+](C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC=C35
Parent-child relations graph
 Deprecated MNXref IDs graph
Similar chemical compounds in external resources
IdentifierDescription
CHEBI:59950
chebi:59950 		neopinone
3-methoxy-17-methyl-6-oxo-8,14-didehydro-4,5alpha-epoxymorphinan-17-ium
neopinone(1+)
kegg.compound:C06172
keggC:C06172 		Neopinone
seed.compound:cpd03682
seedM:cpd03682 		Neopinone
neopinone
metacyc.compound:CPD-7712
metacycM:CPD-7712 		neopinone
CHEBI:7510
chebi:7510 		neopinone
3-methoxy-17-methyl-8,14-didehydro-4,5alpha-epoxymorphinan-6-one
Neopinone
keggC:M_C06172
seedM:M_cpd03682 		secondary/obsolete/fantasy identifier