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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.

Term:ritalinic acid
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Accession:CHEBI:83481 term browser browse the term
Definition:A monocarboxylic acid that is phenylacetic acid substituted by a piperidin-2-yl group at position 2. It is a metabolite of the drug methylphenidate.
Synonyms:exact_synonym: phenyl(piperidin-2-yl)acetic acid
 related_synonym: Formula=C13H17NO2;   InChI=1S/C13H17NO2/c15-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-3,6-7,11-12,14H,4-5,8-9H2,(H,15,16);   InChIKey=INGSNVSERUZOAK-UHFFFAOYSA-N;   SMILES=OC(=O)C(C1CCCCN1)c1ccccc1;   alpha-phenyl-2-piperidineacetic acid
 xref: CAS:19395-41-6
 xref_mesh: MESH:C009189
 xref: PMID:22204874;   PMID:23500822;   PMID:24452069;   PMID:25121992;   Reaxys:86213



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ritalinic acid term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Ces1d carboxylesterase 1D increases chemical synthesis
multiple interactions
ISO CES1 protein results in increased chemical synthesis of ritalinic acid
[CES1 protein results in increased hydrolysis of Methylphenidate] which results in increased chemical synthesis of ritalinic acid
CTD PMID:20097249 NCBI chr19:13,873,490...13,912,035 JBrowse link

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  CHEBI ontology 19808
    role 19757
      biological role 19757
        biochemical role 19377
          metabolite 19352
            xenobiotic metabolite 14478
              marine xenobiotic metabolite 4033
                ritalinic acid 1
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Term Annotations click to browse term
  CHEBI ontology 19808
    subatomic particle 19807
      composite particle 19807
        hadron 19807
          baryon 19807
            nucleon 19807
              atomic nucleus 19807
                atom 19807
                  main group element atom 19704
                    p-block element atom 19704
                      carbon group element atom 19626
                        carbon atom 19616
                          organic molecular entity 19616
                            organic group 18725
                              organic divalent group 18716
                                organodiyl group 18716
                                  carbonyl group 18664
                                    carbonyl compound 18664
                                      carboxylic acid 18361
                                        monocarboxylic acid 17631
                                          ritalinic acid 1
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