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CHEBI:754782 - quinine salicylate

Default Structure
ChEBI IDCHEBI:754782
ChEBI Namequinine salicylate
Stars
Last Modified29 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC7H6O3.C20H24N2O2
Net Charge0
Average Mass462.546
Monoisotopic Mass462.21547
SMILESO=C(O)c1ccccc1O.[H][C@]1(C=C)CN2CC[C@H]1C[C@@]2([H])[C@]([H])(O)c1ccnc2ccc(OC)cc12
InChIInChI=1S/C20H24N2O2.C7H6O3/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18;8-6-4-2-1-3-5(6)7(9)10/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3;1-4,8H,(H,9,10)/t13-,14-,19-,20+;/m0./s1
InChIKeyMAYUSTFJKJSJNC-DSXUQNDKSA-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)
quinine salicylate (CHEBI:754782) is a cinchona alkaloid (CHEBI:51323)
Synonyms  Source
Chininum salicylicumChEMBL
Quinine, monosalicylateChEMBL
Quinine salicylateChEMBL