(-)-tortuosamine (CHEBI:31030)

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ChEBI Name	(−)-tortuosamine

ChEBI ID	CHEBI:31030

ChEBI ASCII Name	(-)-tortuosamine

Definition	5,6,7,8-Tetrahydroquinoline in whith the hydrogens at position 6 are substituted by a 3-azabutyl group and a 3,4-dimethoxyphenyl group. (S configuration). It is found in the herb kanna (Sceletium tortuosum).

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

Supplier Information

Download	Molfile XML SDF

Formula

C20H26N2O2

Net Charge

Average Mass

326.43260

Monoisotopic Mass

326.19943

InChI

InChI=1S/C20H26N2O2/c1-21-12-10-20(9-8-17-15(14-20)5-4-11-22-17)16-6-7-18(23-2)19(13-16)24-3/h4-7,11,13,21H,8-10,12,14H2,1-3H3/t20-/m1/s1

InChIKey

QFRVOGLOHJOHAY-HXUWFJFHSA-N

SMILES

CNCC[C@@]1(CCc2ncccc2C1)c1ccc(OC)c(OC)c1

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	(−)-tortuosamine (CHEBI:31030) has role plant metabolite (CHEBI:76924) (−)-tortuosamine (CHEBI:31030) is a quinoline alkaloid (CHEBI:26509)

IUPAC Name

2-[(6S)-6-(3,4-dimethoxyphenyl)-5,6,7,8-tetrahydroquinolin-6-yl]-N-methylethanamine

Registry Number	Type	Source
8075592	Beilstein Registry Number	Beilstein

Last Modified

25 March 2015