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CHEBI:756672 - cinchonidine sulfate

Default Structure
ChEBI IDCHEBI:756672
ChEBI Namecinchonidine sulfate
Stars
Last Modified30 June 2026
SubmitterChEMBL
DownloadsMolfile
FormulaC19H22N2O.C19H22N2O.H2O4S
Net Charge0
Average Mass686.875
Monoisotopic Mass686.31381
SMILESO=S(=O)(O)O.[H][C@@]12CCN(C[C@@H]1C=C)[C@]([H])([C@H](O)c1ccnc3ccccc13)C2.[H][C@@]12CCN(C[C@@H]1C=C)[C@]([H])([C@H](O)c1ccnc3ccccc13)C2
InChIInChI=1S/2C19H22N2O.H2O4S/c2*1-2-13-12-21-10-8-14(13)11-18(21)19(22)16-7-9-20-17-6-4-3-5-15(16)17;1-5(2,3)4/h2*2-7,9,13-14,18-19,22H,1,8,10-12H2;(H2,1,2,3,4)/t2*13-,14-,18-,19+;/m00./s1
InChIKeyWBBHOISPYYYBTC-IDJJGHEZSA-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)
cinchonidine sulfate (CHEBI:756672) is a cinchona alkaloid (CHEBI:51323)
Synonyms  Source
Cinchonidine sulfateChEMBL
Cinchonidine sulfate anhydrousChEMBL
Cinchonidine sulfate, anhydrousChEMBL
Cinchonidine sulphate anhydrousChEMBL
TCMDC-123934ChEMBL