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Neuroscience Information Framework (NIF) Standard Ontology
Last uploaded:
February 10, 2018
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| Preferred Name | dexmethylphenidate | |
| Synonyms |
methyl (R)-phenyl[(R)-piperidin-2-yl]acetate dexmetilfenidato d-threo-methylphenidate (+)-threo-methylphenidate dexmethylphenidate dexmethylphenidatum methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate |
|
| Definitions |
A methyl phenyl(piperidin-2-yl)acetate in which both stereocentres have R configuration. It is the active enantiomer in the racemic drug methylphenidate. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_51860 |
|
| alternative label |
methyl (R)-phenyl[(R)-piperidin-2-yl]acetate dexmetilfenidato d-threo-methylphenidate (+)-threo-methylphenidate dexmethylphenidate dexmethylphenidatum methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate
|
|
| charge |
0
|
|
| database_cross_reference |
Drug_Central:836 Beilstein:6116309 Wikipedia:Dexmethylphenidate CAS:40431-64-9
|
|
| definition |
A methyl phenyl(piperidin-2-yl)acetate in which both stereocentres have R configuration. It is the active enantiomer in the racemic drug methylphenidate.
|
|
| formula |
C14H19NO2
|
|
| has characteristic | ||
| has exact synonym |
methyl (2R)-phenyl[(2R)-piperidin-2-yl]acetate
|
|
| has role | ||
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
methyl (R)-phenyl[(R)-piperidin-2-yl]acetate dexmetilfenidato d-threo-methylphenidate (+)-threo-methylphenidate dexmethylphenidate dexmethylphenidatum
|
|
| id |
CHEBI:51860
|
|
| in_subset | ||
| inchi |
InChI=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
|
|
| inchikey |
DUGOZIWVEXMGBE-CHWSQXEVSA-N
|
|
| is enantiomer of | ||
| label |
dexmethylphenidate
|
|
| mass |
233.30620
|
|
| monoisotopicmass |
233.14158
|
|
| notation |
CHEBI:51860
|
|
| note |
A methyl phenyl(piperidin-2-yl)acetate in which both stereocentres have R configuration. It is the active enantiomer in the racemic drug methylphenidate.
|
|
| preferred label |
dexmethylphenidate
|
|
| prefLabel |
dexmethylphenidate
|
|
| smiles |
COC(=O)[C@@H]([C@H]1CCCCN1)c1ccccc1
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|
| subClassOf |
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