Submit Data |  Help |  Video Tutorials |  News |  Publications |  FTP Download |  REST API |  Citing RGD |  Contact   

ONTOLOGY REPORT - ANNOTATIONS


Term:atenolol acid
go back to main search page
Accession:CHEBI:83478 term browser browse the term
Definition:A monocarboxylic acid that is phenylacetic acid substituted by a 2-hydroxy-3-(propan-2-ylamino)propoxy group at position 4. It is a metabolite of the drug atenolol.
Synonyms:exact_synonym: {4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}acetic acid
 related_synonym: (2-Hydroxy-3-((1-methylethyl)amino)propoxy)benzeneacetic acid;   Formula=C14H21NO4;   InChI=1S/C14H21NO4/c1-10(2)15-8-12(16)9-19-13-5-3-11(4-6-13)7-14(17)18/h3-6,10,12,15-16H,7-9H2,1-2H3,(H,17,18);   InChIKey=PUQIRTNPJRFRCZ-UHFFFAOYSA-N;   Metoprolol acid;   SMILES=CC(C)NCC(O)COc1ccc(CC(O)=O)cc1
 xref: CAS:56392-14-4 "ChemIDplus";   PMID:24033151 "Europe PMC";   PMID:24070867 "Europe PMC";   PMID:25310538 "Europe PMC";   Reaxys:8774963 "Reaxys"


show annotations for term's descendants       view all columns           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19764
    role 19711
      application 19362
        refrigerant 17253
          ammonia 16699
            organic amino compound 16698
              secondary amino compound 6382
                atenolol acid 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19764
    subatomic particle 19762
      composite particle 19762
        hadron 19762
          baryon 19762
            nucleon 19762
              atomic nucleus 19762
                atom 19762
                  main group element atom 19646
                    p-block element atom 19646
                      carbon group element atom 19540
                        carbon atom 19529
                          organic molecular entity 19529
                            organic group 18432
                              organic divalent group 18423
                                organodiyl group 18423
                                  carbonyl group 18311
                                    carbonyl compound 18311
                                      carboxylic acid 17978
                                        monocarboxylic acid 17287
                                          atenolol acid 0
paths to the root

NHLBI Logo

RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.