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CHEBI:93866 - 2-hydroxy-2-phenylacetic acid [(5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester

ChEBI IDCHEBI:93866
ChEBI Name2-hydroxy-2-phenylacetic acid [(5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester
Stars
DownloadsMolfile
FormulaC17H24NO3
Net Charge+1
Average Mass290.383
Monoisotopic Mass290.17507
SMILESC[N+]1(C)C2CC[C@H]1CC(OC(=O)C(O)c1ccccc1)C2
InChIInChI=1S/C17H24NO3/c1-18(2)13-8-9-14(18)11-15(10-13)21-17(20)16(19)12-6-4-3-5-7-12/h3-7,13-16,19H,8-11H2,1-2H3/q+1/t13-,14?,15?,16?/m0/s1
InChIKeyWKWOJBUWWZTUQV-CUUNVARJSA-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)
2-hydroxy-2-phenylacetic acid [(5S)-8,8-dimethyl-8-azoniabicyclo[3.2.1]octan-3-yl] ester (CHEBI:93866) is a tropane alkaloid (CHEBI:37332)
Manual XrefsDatabases
LSM-4438LINCS