CHEBI:59950 - neopinone(1+)

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ChEBI Name neopinone(1+) ChEBI ID CHEBI:59950 Definition The trialkylammonium ion resulting from the protonation of the amino group of neopinone. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C18H20NO3 Net Charge +1 Average Mass 298.35630 Monoisotopic Mass 298.14377 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/h3-4,6,12,17H,5,7-9H2,1-2H3/p+1/t12-,17+,18+/m1/s1 InChIKey LJVKMVSYTWPNGA-UUWFMWQGSA-O SMILES COc1ccc2C[C@H]3[NH+](C)CC[C@@]45[C@@H](Oc1c24)C(=O)CC=C35 ChEBI Ontology Outgoing neopinone(1+) (CHEBI:59950) is a ammonium ion derivative (CHEBI:35274) neopinone(1+) (CHEBI:59950) is conjugate acid of neopinone (CHEBI:7510) Incoming neopinone (CHEBI:7510) is conjugate base of neopinone(1+) (CHEBI:59950) IUPAC Name 3-methoxy-17-methyl-6-oxo-8,14-didehydro-4,5α-epoxymorphinan-17-ium Synonym Source neopinone UniProt Manual Xref Database CPD-7712 MetaCyc View more database links Citation Type Source 20228795 PubMed citation Europe PMC Last Modified 27 March 2023