CHEBI:35643 - aporphine

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ChEBI Name aporphine
Definition An isoquinoline alkaloid that is the N-methyl derivative of 5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C17H17N
Net Charge 0
Average Mass 235.32362
Monoisotopic Mass 235.136
InChI InChI=1S/C17H17N/c1-18-10-9-12-6-4-8-15-14-7-3-2-5-13(14)11-16(18)17(12)15/h2-8,16H,9-11H2,1H3
SMILES CN1CCc2cccc3-c4ccccc4CC1c23
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
Biological Role(s): metabolite
Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
(via alkaloid )
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ChEBI Ontology
Outgoing aporphine (CHEBI:35643) is a aporphine alkaloid (CHEBI:134209)
aporphine (CHEBI:35643) is a isoquinoline alkaloid fundamental parent (CHEBI:38515)
aporphine (CHEBI:35643) is a tertiary amino compound (CHEBI:50996)
Incoming 7-oxohernangerine (CHEBI:66841) has functional parent aporphine (CHEBI:35643)
bulbocapnine (CHEBI:3211) has functional parent aporphine (CHEBI:35643)
laurolistine (CHEBI:66557) has functional parent aporphine (CHEBI:35643)
lindechunine A (CHEBI:66577) has functional parent aporphine (CHEBI:35643)
liriodenine (CHEBI:70649) has functional parent aporphine (CHEBI:35643)
oxonantenine (CHEBI:70651) has functional parent aporphine (CHEBI:35643)
(−)-annonaine (CHEBI:76) has parent hydride aporphine (CHEBI:35643)
apomorphine (CHEBI:48538) has parent hydride aporphine (CHEBI:35643)
isothebaine (CHEBI:6066) has parent hydride aporphine (CHEBI:35643)
Synonym Source
6-methyl-5,6,6a,7-tetrahydro-4H-dibenzo[de,g]quinoline IUPAC
Registry Numbers Types Sources
192257 Beilstein Registry Number Beilstein
478-57-9 CAS Registry Number ChemIDplus
Last Modified
04 January 2017