CHEBI:18363 - reticulinylium

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ChEBI Name reticulinylium
ChEBI ID CHEBI:18363
Definition A benzylisoquinoline alkaloid that is obtained by selective dehydrogenation at the 1,2-position of reticuline.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:490, CHEBI:11143, CHEBI:18872
Supplier Information
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Formulae C19H22NO4
C19H22NO4
Net Charge +1
Average Mass 328.38230
Monoisotopic Mass 328.15433
InChI InChI=1S/C19H21NO4/c1-20-7-6-13-10-19(24-3)17(22)11-14(13)15(20)8-12-4-5-18(23-2)16(21)9-12/h4-5,9-11H,6-8H2,1-3H3,(H-,21,22)/p+1
InChIKey ZALYXKJOOUDZCC-UHFFFAOYSA-O
SMILES COc1ccc(CC2=[N+](C)CCc3cc(OC)c(O)cc23)cc1O
Roles Classification
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 )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing reticulinylium (CHEBI:18363) has functional parent reticuline (CHEBI:26533)
reticulinylium (CHEBI:18363) is a benzylisoquinoline alkaloid (CHEBI:22750)
reticulinylium (CHEBI:18363) is a organic cation (CHEBI:25697)
IUPAC Name
7-hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-3,4-dihydroisoquinolinium
Synonyms Sources
1,2-Dehydroreticuline KEGG COMPOUND
1,2-dehydroreticuline UniProt
1,2-Dehydroreticulinium KEGG COMPOUND
3,4-Dihydro-7-hydroxy-1-[(3-hydroxy-4-methoxyphenyl)methyl]-6-methoxy-2-(methyl-14C)-isoquinolinium KEGG COMPOUND
Manual Xrefs Databases
C00027111 KNApSAcK
C06167 KEGG COMPOUND
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Registry Numbers Types Sources
16202-17-8 CAS Registry Number KEGG COMPOUND
4158880 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
15081299 PubMed citation Europe PMC
15921406 PubMed citation Europe PMC
Last Modified
13 November 2017