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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:bevantolol
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Accession:CHEBI:238698 term browser browse the term
Definition:A propanolamine that is 3-aminopropane-1,2-diol in which the hydrogen of the primary hydroxy group is substituted by 3-methylphenyl and one of the hydrogens attached to the nitrogen is substituted by 2-(3,4-dimethoxyphenyl)ethyl. A beta1 adrenoceptor antagonist, it has been shown to be as effective as other beta-blockers for the treatment of angina pectoris and hypertension.
Synonyms:exact_synonym: 1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-(3-methylphenoxy)propan-2-ol
 related_synonym: 1-((2-(3,4-dimethoxyphenyl)ethyl)amino)-3-(3-methylphenoxy)-2-propanol;   1-(3,4-dimethoxyphenethylamino)-3-(m-tolyloxy)-2-propanol;   1-(3,4-dimethoxyphenethylamino)-3-m-tolyloxy-propan-2-ol;   1-[2-(3,4-Dimethoxy-phenyl)-ethylamino]-3-m-tolyloxy-propan-2-ol;   Formula=C20H27NO4;   InChI=1S/C20H27NO4/c1-15-5-4-6-18(11-15)25-14-17(22)13-21-10-9-16-7-8-19(23-2)20(12-16)24-3/h4-8,11-12,17,21-22H,9-10,13-14H2,1-3H3;   InChIKey=HXLAFSUPPDYFEO-UHFFFAOYSA-N;   SMILES=COc1ccc(CCNCC(O)COc2cccc(C)c2)cc1OC;   bevantololum
 xref: Beilstein:2769444;   CAS:59170-23-9;   DrugBank:DB01295;   Drug_Central:360
 xref_mesh: MESH:C021148
 xref: PMID:2871781;   PMID:2894292;   Patent:BE790165;   Patent:US3857891;   Patent:US4994618;   Reaxys:2769444


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bevantolol term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Adrb1 adrenoceptor beta 1 decreases expression EXP bevantolol results in decreased expression of ADRB1 mRNA CTD PMID:17628611 NCBI chr 1:255,771,962...255,774,973
Ensembl chr 1:255,771,597...255,807,259 		JBrowse link
Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19841
    role 19817
      biological role 19815
        pharmacological role 19058
          antagonist 17239
            calcium channel blocker 7163
              bevantolol 1
                (R)-bevantolol 0
                (S)-bevantolol 0
                bevantolol hydrochloride + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19841
    subatomic particle 19839
      composite particle 19839
        hadron 19839
          baryon 19839
            nucleon 19839
              atomic nucleus 19839
                atom 19839
                  main group element atom 19789
                    main group molecular entity 19789
                      s-block molecular entity 19626
                        hydrogen molecular entity 19613
                          hydrides 19120
                            inorganic hydride 18118
                              pnictogen hydride 18107
                                nitrogen hydride 18014
                                  azane 17824
                                    ammonia 17823
                                      organic amino compound 17823
                                        amino alcohol 1072
                                          propanolamine 176
                                            bevantolol 1
                                              (R)-bevantolol 0
                                              (S)-bevantolol 0
                                              bevantolol hydrochloride + 0
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