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CHEBI:172381 - Methyl 2-(naphthalen-2-yl)-2-(piperidin-2-yl)acetate

ChEBI IDCHEBI:172381
ChEBI NameMethyl 2-(naphthalen-2-yl)-2-(piperidin-2-yl)acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H21NO2
Net Charge0
Average Mass283.371
Monoisotopic Mass283.15723
SMILES[H][C@]1([C@H](C(=O)OC)c2ccc3ccccc3c2)CCCCN1
InChIInChI=1S/C18H21NO2/c1-21-18(20)17(16-8-4-5-11-19-16)15-10-9-13-6-2-3-7-14(13)12-15/h2-3,6-7,9-10,12,16-17,19H,4-5,8,11H2,1H3/t16-,17-/m1/s1
InChIKeyDNRNSIJBSCBESJ-IAGOWNOFSA-N
Species of MetaboliteComponentSourceComments
Staphylococcus aureus (ncbitaxon:1280)
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105) Strain: Staphylococcus aureus subsp. aureus USA300 [NCBI:txid367830]
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
unidentified (ncbitaxon:32644) Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
Pseudomonas aeruginosa (ncbitaxon:287)
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105) Strain: Pseudomonas aeruginosa UCBPP-PA14 [NCBI:txid208963]
Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
Pseudomonas aeruginosa;Staphylococcus aureus (ncbitaxon:1280) Culture media, conditioned (OMIT:0017487) MetaboLights (MTBLS2105)
ChEBI Ontology
Outgoing Relation(s)
Methyl 2-(naphthalen-2-yl)-2-(piperidin-2-yl)acetate (CHEBI:172381) is a naphthalenes (CHEBI:25477)
IUPAC Name 
methyl (2R)-2-naphthalen-2-yl-2-[(2R)-piperidin-2-yl]acetate
Manual XrefsDatabases
7993011ChemSpider
Registry NumbersSources
CAS:231299-82-4ChemIDplus