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 23806
    role 23693
      application 23081
        refrigerant 18884
          ammonia 18322
            organic amino compound 18321
              secondary amino compound 6504
                atenolol acid 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 23806
    subatomic particle 23757
      composite particle 23757
        hadron 23757
          baryon 23757
            nucleon 23757
              atomic nucleus 23757
                atom 23757
                  main group element atom 23576
                    p-block element atom 23576
                      carbon group element atom 23289
                        carbon atom 23243
                          organic molecular entity 23243
                            organic group 21926
                              organic divalent group 21898
                                organodiyl group 21898
                                  carbonyl group 21869
                                    carbonyl compound 21869
                                      carboxylic acid 20919
                                        monocarboxylic acid 19818
                                          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.