(S)-magnoflorine (CHEBI:6641)

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ChEBI Name	(S)-magnoflorine

ChEBI ID	CHEBI:6641

ChEBI ASCII Name	(S)-magnoflorine

Definition	An aporphine alkaloid that is (S)-corytuberine in which the nitrogen has been quaternised by an additional methyl group.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C20H24NO4

Net Charge

Average Mass

342.410

Monoisotopic Mass

342.16998

InChI

InChI=1S/C20H23NO4/c1-21(2)8-7-12-10-15(25-4)20(23)18-16(12)13(21)9-11-5-6-14(24-3)19(22)17(11)18/h5-6,10,13H,7-9H2,1-4H3,(H-,22,23)/p+1/t13-/m0/s1

InChIKey

YLRXAIKMLINXQY-ZDUSSCGKSA-O

SMILES

C12=C3C4=C(C=CC(=C4O)OC)C[C@@]1([N+](CCC2=CC(=C3O)OC)(C)C)[H]

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via alkaloid )

ChEBI Ontology
Outgoing	(S)-magnoflorine (CHEBI:6641) has functional parent (S)-corytuberine (CHEBI:81200) (S)-magnoflorine (CHEBI:6641) has role plant metabolite (CHEBI:76924) (S)-magnoflorine (CHEBI:6641) is a aporphine alkaloid (CHEBI:134209) (S)-magnoflorine (CHEBI:6641) is a quaternary ammonium ion (CHEBI:35267)

IUPAC Name

(6aS)-1,11-dihydroxy-2,10-dimethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolinium

Last Modified

04 January 2017