CHEBI:146259 - ibogaine(1+)

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ChEBI Name ibogaine(1+) ChEBI ID CHEBI:146259 Definition A tertiary ammonium ion resulting from the protonation of the tertiary amino group of ibogaine. Stars This entity has been manually annotated by the ChEBI Team. Submitter Kristian Axelsen Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C20H27N2O Net Charge +1 Average Mass 311.448 Monoisotopic Mass 311.21179 InChI InChI=1S/C20H26N2O/c1-3-13-8-12-9-17-19-15(6-7-22(11-12)20(13)17)16-10-14(23-2)4-5-18(16)21-19/h4-5,10,12-13,17,20-21H,3,6-9,11H2,1-2H3/p+1/t12-,13+,17+,20+/m1/s1 InChIKey HSIBGVUMFOSJPD-CFDPKNGZSA-O SMILES [C@@]12([C@@]3([C@H](C[C@](C1)(C[N+]3(CCC=4C5=C(C=CC(=C5)OC)NC42)[H])[H])CC)[H])[H] ChEBI Ontology Outgoing ibogaine(1+) (CHEBI:146259) has functional parent noribogaine(1+) (CHEBI:146258) ibogaine(1+) (CHEBI:146259) is a tertiary ammonium ion (CHEBI:137982) ibogaine(1+) (CHEBI:146259) is conjugate acid of ibogaine (CHEBI:5852) Incoming ibogaine (CHEBI:5852) is conjugate base of ibogaine(1+) (CHEBI:146259) IUPAC Name (6S,18R)-12-methoxyibogamin-6-ium Synonym Source (−)-ibogaine UniProt Manual Xrefs Databases CPD-21566 MetaCyc Ibogaine Wikipedia View more database links Citation Type Source 30030374 PubMed citation SUBMITTER Last Modified 06 March 2020