CHEBI:59908 - ecgoninium methyl ester(1+)

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ChEBI Name ecgoninium methyl ester(1+) ChEBI ID CHEBI:59908 Definition The conjugate acid of ecgonine methyl ester arising from protonation of the tertiary amino group; major species at pH 7.3. Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat 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 C10H18NO3 Net Charge +1 Average Mass 200.25480 Monoisotopic Mass 200.12812 InChI InChI=1S/C10H17NO3/c1-11-6-3-4-7(11)9(8(12)5-6)10(13)14-2/h6-9,12H,3-5H2,1-2H3/p+1/t6-,7+,8-,9+/m0/s1 InChIKey QIQNNBXHAYSQRY-UYXSQOIJSA-O SMILES [H][C@]12CC[C@]([H])([C@H]([C@@H](O)C1)C(=O)OC)[NH+]2C Metabolite of Species Details Homo sapiens (NCBI:txid9606) See: DOI Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing ecgoninium methyl ester(1+) (CHEBI:59908) has role human metabolite (CHEBI:77746) ecgoninium methyl ester(1+) (CHEBI:59908) is a ammonium ion derivative (CHEBI:35274) ecgoninium methyl ester(1+) (CHEBI:59908) is conjugate acid of ecgonine methyl ester (CHEBI:31529) Incoming ecgonine methyl ester (CHEBI:31529) is conjugate base of ecgoninium methyl ester(1+) (CHEBI:59908) IUPAC Name (1R,2R,3S,5S)-3-hydroxy-2-(methoxycarbonyl)-8-methyl-8-azoniabicyclo[3.2.1]octane Synonym Source ecgonine methyl ester UniProt Last Modified 10 March 2014