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CHEBI:67520 - gardneramine-N(4)-oxide

ChEBI IDCHEBI:67520
ChEBI Namegardneramine-N(4)-oxide
Stars
DefinitionA natural product found in Gardneria ovata.
Last Modified1 February 2017
DownloadsMolfile
FormulaC23H28N2O6
Net Charge0
Average Mass428.485
Monoisotopic Mass428.19474
SMILES[H][C@@]12COC3=Nc4c(OC)cc(OC)c(OC)c4[C@@]34C[C@]1([H])[N+]1([O-])C/C(=C\COC)[C@]2([H])C[C@@]41[H]
InChIInChI=1S/C23H28N2O6/c1-27-6-5-12-10-25(26)15-9-23-18(25)7-13(12)14(15)11-31-22(23)24-20-16(28-2)8-17(29-3)21(30-4)19(20)23/h5,8,13-15,18H,6-7,9-11H2,1-4H3/b12-5+/t13-,14-,15-,18-,23-,25?/m0/s1
InChIKeyKYRGYFIBUVLRAO-WBZVWLCISA-N
Species of MetaboliteComponentSourceComments
Gardneria ovata (ncbitaxon:84944) aerial part (BTO:0001658) PubMed (21425787) 90% methanolic extract of air-dried and powdered aerial parts
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
gardneramine-N(4)-oxide (CHEBI:67520) has role metabolite (CHEBI:25212)
gardneramine-N(4)-oxide (CHEBI:67520) is a tertiary amine oxide (CHEBI:134363)
gardneramine-N(4)-oxide (CHEBI:67520) is a tropane alkaloid (CHEBI:37332)
Citations