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CHEBI:46816 - norreticuline

ChEBI IDCHEBI:46816
ChEBI Namenorreticuline
Stars
Secondary ChEBI IDsCHEBI:25596, CHEBI:31032
Last Modified17 October 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC18H21NO4
Net Charge0
Average Mass315.369
Monoisotopic Mass315.14706
SMILESCOc1ccc(CC2NCCc3cc(OC)c(O)cc32)cc1O
InChIInChI=1S/C18H21NO4/c1-22-17-4-3-11(8-15(17)20)7-14-13-10-16(21)18(23-2)9-12(13)5-6-19-14/h3-4,8-10,14,19-21H,5-7H2,1-2H3
InChIKeyFVEMXQCEJGGXJB-UHFFFAOYSA-N
Roles Classification
Biological Role:
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)
norreticuline (CHEBI:46816) is a benzylisoquinoline alkaloid (CHEBI:22750)
norreticuline (CHEBI:46816) is a benzyltetrahydroisoquinoline (CHEBI:26901)
norreticuline (CHEBI:46816) is a isoquinolinol (CHEBI:24923)
norreticuline (CHEBI:46816) is conjugate base of norreticuline(1+) (CHEBI:194517)
Incoming Relation(s)
(S)-norcodamine(1+) (CHEBI:143271) has functional parent norreticuline (CHEBI:46816)
(R)-norreticuline (CHEBI:28658) is a norreticuline (CHEBI:46816)
(S)-norreticuline (CHEBI:28611) is a norreticuline (CHEBI:46816)
norreticuline(1+) (CHEBI:194517) is conjugate acid of norreticuline (CHEBI:46816)
IUPAC Name 
1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolin-7-ol
Synonyms  Source
(R,S)-NorreticulineKEGG COMPOUND
NorreticulineKEGG COMPOUND
Manual XrefsDatabases
C12329KEGG COMPOUND
Registry NumbersSources
Beilstein:1550529Beilstein
CAS:13168-51-9ChemIDplus