CHEBI:57873 - (S)-reticulinium(1+)

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ChEBI Name (S)-reticulinium(1+)
ChEBI ID CHEBI:57873
ChEBI ASCII Name (S)-reticulinium(1+)
Definition An ammonium ion that is the conjugate acid of (S)-reticuline, arising from protonation of the tertiary amino group; major species at pH 7.3.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C19H24NO4
Net Charge +1
Average Mass 330.39820
Monoisotopic Mass 330.16998
InChI InChI=1S/C19H23NO4/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/h4-5,9-11,15,21-22H,6-8H2,1-3H3/p+1/t15-/m0/s1
InChIKey BHLYRWXGMIUIHG-HNNXBMFYSA-O
SMILES COc1ccc(C[C@@H]2[NH+](C)CCc3cc(OC)c(O)cc23)cc1O
ChEBI Ontology
Outgoing (S)-reticulinium(1+) (CHEBI:57873) is a ammonium ion (CHEBI:35274)
(S)-reticulinium(1+) (CHEBI:57873) is conjugate acid of (S)-reticuline (CHEBI:16718)
Incoming (S)-reticuline (CHEBI:16718) is conjugate base of (S)-reticulinium(1+) (CHEBI:57873)
IUPAC Name
(1S)-7-hydroxy-1-(3-hydroxy-4-methoxybenzyl)-6-methoxy-2-methyl-1,2,3,4-tetrahydroisoquinolinium
Synonyms Sources
(S)-reticuline UniProt
(S)-reticulinium cation ChEBI
Last Modified
17 October 2013