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CHEBI:77618 - norajmaline(1+)

ChEBI IDCHEBI:77618
ChEBI Namenorajmaline(1+)
Stars
DefinitionAn organic cation obtained by protonation of the tertiary amino group of norajmaline; major structure at pH 7.3.
Last Modified17 April 2014
SubmitterAnne Morgat
DownloadsMolfile
FormulaC19H25N2O2
Net Charge+1
Average Mass313.421
Monoisotopic Mass313.19105
SMILES[H][C@@]12C3C[C@]4(c5ccccc5N[C@@]4([H])[C@]4([H])C[C@H]1[C@H](CC)[C@@H](O)[NH+]34)[C@@H]2O
InChIInChI=1S/C19H24N2O2/c1-2-9-10-7-13-16-19(11-5-3-4-6-12(11)20-16)8-14(15(10)17(19)22)21(13)18(9)23/h3-6,9-10,13-18,20,22-23H,2,7-8H2,1H3/p+1/t9-,10-,13-,14?,15-,16-,17+,18+,19+/m0/s1
InChIKeyHIOAYNMZFIHQNS-WGSNPMNHSA-O
ChEBI Ontology
Outgoing Relation(s)
norajmaline(1+) (CHEBI:77618) is a ammonium ion derivative (CHEBI:35274)
norajmaline(1+) (CHEBI:77618) is a organic cation (CHEBI:25697)
norajmaline(1+) (CHEBI:77618) is conjugate acid of norajmaline (CHEBI:7621)
Incoming Relation(s)
norajmaline (CHEBI:7621) is conjugate base of norajmaline(1+) (CHEBI:77618)
IUPAC Name 
(2β,7β,17R,20β,21α)-17,21-dihydroxy-2,7,19,20-tetrahydro-7,17-cyclosarpagan-4-ium
UniProt Name  Source
norajmalineUniProt