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CHEBI:94832 - [(1R,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate

ChEBI IDCHEBI:94832
ChEBI Name[(1R,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate
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DownloadsMolfile
Formula2C17H23NO3
Net Charge0
Average Mass578.750
Monoisotopic Mass578.33559
SMILESCN1[C@@H]2CC[C@@H]1CC(OC(=O)C(CO)c1ccccc1)C2.CN1[C@@H]2CC[C@@H]1CC(OC(=O)C(CO)c1ccccc1)C2
InChIInChI=1S/2C17H23NO3/c2*1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2*2-6,13-16,19H,7-11H2,1H3/t2*13-,14-,16?/m11/s1
InChIKeyNBLUPZBTGKMBNV-BSNGCFTNSA-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)
[(1R,5R)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 3-hydroxy-2-phenylpropanoate (CHEBI:94832) is a tropane alkaloid (CHEBI:37332)
Manual XrefsDatabases
LSM-6044LINCS