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CHEBI:143273 - (S)-norreticuline(1+)

ChEBI IDCHEBI:143273
ChEBI Name(S)-norreticuline(1+)
Stars
ASCII Name(S)-norreticuline(1+)
DefinitionA secondary ammonium ion that is the conjugate acid of (S)-norreticuline, resulting from the protonation of the secondary amino group. The major species at pH 7.3.
Last Modified19 July 2019
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC18H22NO4
Net Charge+1
Average Mass316.377
Monoisotopic Mass316.15433
SMILESCOc1ccc(C[C@@H]2[NH2+]CCc3cc(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/p+1/t14-/m0/s1
InChIKeyFVEMXQCEJGGXJB-AWEZNQCLSA-O
ChEBI Ontology
Outgoing Relation(s)
(S)-norreticuline(1+) (CHEBI:143273) is a norreticuline(1+) (CHEBI:194517)
(S)-norreticuline(1+) (CHEBI:143273) is a secondary ammonium ion (CHEBI:137419)
(S)-norreticuline(1+) (CHEBI:143273) is conjugate acid of (S)-norreticuline (CHEBI:28611)
Incoming Relation(s)
(S)-norreticuline (CHEBI:28611) is conjugate base of (S)-norreticuline(1+) (CHEBI:143273)
IUPAC Name 
(1S)-7-hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-1,2,3,4-tetrahydroisoquinolinium
UniProt Name  Source
(S)-norreticulineUniProt
Manual XrefsDatabases
CPD-15799MetaCyc
Citations