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CHEBI:35933 - cinchonan

ChEBI IDCHEBI:35933
ChEBI Namecinchonan
Stars
Last Modified14 July 2015
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC19H22N2
Net Charge0
Average Mass278.399
Monoisotopic Mass278.17830
SMILESC=C[C@H]1C[N@]2CC[C@H]1C[C@@H]2Cc1ccnc2ccccc12
InChIInChI=1S/C19H22N2/c1-2-14-13-21-10-8-15(14)11-17(21)12-16-7-9-20-19-6-4-3-5-18(16)19/h2-7,9,14-15,17H,1,8,10-13H2/t14-,15-,17+/m0/s1
InChIKeyUFJOYVQIDSNLHC-YQQAZPJKSA-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)
cinchonan (CHEBI:35933) is a (8ξ)-cinchonan (CHEBI:59137)
cinchonan (CHEBI:35933) is a cinchona alkaloid (CHEBI:51323)
cinchonan (CHEBI:35933) is a quinoline alkaloid fundamental parent (CHEBI:38514)
cinchonan (CHEBI:35933) is a quinuclidines (CHEBI:26518)
Incoming Relation(s)
optochin (CHEBI:86455) has functional parent cinchonan (CHEBI:35933)
cinchonine (CHEBI:27509) has parent hydride cinchonan (CHEBI:35933)
cupreine (CHEBI:28582) has parent hydride cinchonan (CHEBI:35933)
quinidine (CHEBI:28593) has parent hydride cinchonan (CHEBI:35933)
IUPAC Name 
cinchonan
Registry NumbersSources
Beilstein:88420Beilstein