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> Main
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
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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
View more database links
Registry Numbers
Types
Sources
16202-17-8
CAS Registry Number
KEGG COMPOUND
4158880
Reaxys Registry Number
Reaxys
Citations
Types
Sources
15081299
PubMed citation
Europe PMC
15921406
PubMed citation
Europe PMC
Last Modified
13 November 2017