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CHEBI:51860 - dexmethylphenidate

ChEBI IDCHEBI:51860
ChEBI Namedexmethylphenidate
Stars
DefinitionA methyl phenyl(piperidin-2-yl)acetate in which both stereocentres have R configuration. It is the active enantiomer in the racemic drug methylphenidate.
Last Modified22 February 2017
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC14H19NO2
Net Charge0
Average Mass233.311
Monoisotopic Mass233.14158
SMILES[H][C@]1([C@]([H])(C(=O)OC)c2ccccc2)CCCCN1
InChIInChI=1S/C14H19NO2/c1-17-14(16)13(11-7-3-2-4-8-11)12-9-5-6-10-15-12/h2-4,7-8,12-13,15H,5-6,9-10H2,1H3/t12-,13-/m1/s1
InChIKeyDUGOZIWVEXMGBE-CHWSQXEVSA-N
Wikipedia
Roles Classification
Biological Role:
adrenergic agent  Any agent that acts on an adrenergic receptor or affects the life cycle of an adrenergic transmitter.
Application:
adrenergic agent  Any agent that acts on an adrenergic receptor or affects the life cycle of an adrenergic transmitter.
ChEBI Ontology
Outgoing Relation(s)
dexmethylphenidate (CHEBI:51860) has role adrenergic agent (CHEBI:37962)
dexmethylphenidate (CHEBI:51860) is a methyl phenyl(piperidin-2-yl)acetate (CHEBI:84276)
dexmethylphenidate (CHEBI:51860) is enantiomer of methyl (S)-phenyl[(S)-piperidin-2-yl]acetate (CHEBI:51857)
Incoming Relation(s)
methylphenidate (CHEBI:6887) has part dexmethylphenidate (CHEBI:51860)
methyl (S)-phenyl[(S)-piperidin-2-yl]acetate (CHEBI:51857) is enantiomer of dexmethylphenidate (CHEBI:51860)
IUPAC Name 
methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate
INNs  Source
dexmethylphenidateWHO MedNet
dexméthylphénidateWHO MedNet
dexmethylphenidatumWHO MedNet
dexmetilfenidatoWHO MedNet
Synonyms  Source
d-threo-methylphenidateChemIDplus
(+)-threo-methylphenidateChemIDplus
methyl (R)-phenyl[(R)-piperidin-2-yl]acetateChEBI
Manual XrefsDatabases
836DrugCentral
DexmethylphenidateWikipedia
Registry NumbersSources
Beilstein:6116309Beilstein
CAS:40431-64-9ChemIDplus