(S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+) (CHEBI:134213)

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ChEBI Name	(S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+)

ChEBI ID	CHEBI:134213

ChEBI ASCII Name	(S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+)

Definition	A aporphine alkaloid that is the quaternary ammonium ion obtained by methylation of the tertiary amino group of (S)-glaucine.

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

Submitter	Kristian Axelsen

Supplier Information

Download	Molfile XML SDF

Formula

C22H28NO4

Net Charge

Average Mass

370.463

Monoisotopic Mass

370.20128

InChI

InChI=1S/C22H28NO4/c1-23(2)8-7-13-10-19(26-5)22(27-6)21-15-12-18(25-4)17(24-3)11-14(15)9-16(23)20(13)21/h10-12,16H,7-9H2,1-6H3/q+1/t16-/m0/s1

InChIKey

WKHHFWJJIRCXHA-INIZCTEOSA-N

SMILES

C12=C3[C@](CC4=C1C=C(OC)C(=C4)OC)([N+](CCC3=CC(=C2OC)OC)(C)C)[H]

Metabolite of Species	Details
Isopyrum thalictroides (NCBI:txid432643)	Found in rhizome (BTO:0001181). See: PubMed
Isopyrum thalictroides (NCBI:txid432643)	Found in root (BTO:0001188). See: PubMed

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)-1,2,9,10-tetramethoxy-6-methylaporphine(1+) (CHEBI:134213) has functional parent (S)-glaucine (CHEBI:5373) (S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+) (CHEBI:134213) has role plant metabolite (CHEBI:76924) (S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+) (CHEBI:134213) is a aporphine alkaloid (CHEBI:134209) (S)-1,2,9,10-tetramethoxy-6-methylaporphine(1+) (CHEBI:134213) is a quaternary ammonium ion (CHEBI:35267)

IUPAC Name

(6aS)-1,2,9,10-tetramethoxy-6,6-dimethyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinolin-6-ium

Synonyms	Sources
(S)-1,2,9,10-tetramethoxy-6-methylaporphinium	ChEBI
(S)-N-methylglaucine	UniProt
(S)-N-methylglaucine(1+)	ChEBI
1,2-dimethoxy-N,O,O-trimethylapomorphinium	ChEBI
N-methyl-(S)-glaucine(1+)	ChEBI
N-Methylglaucine	KNApSAcK

Last Modified

06 April 2017