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ONTOLOGY REPORT - ANNOTATIONS


Term:(S)-esmolol
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Accession:CHEBI:60075 term browser browse the term
Definition:A methyl 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoate that has S configuration. The drug esmolol is a racemate comprising equimolar amounts of (R)- and (S)-esmolol. While the S enantiomer possesses all of the heart rate control, both the R and the S enantiomer contribute to lowering blood pressure.
Synonyms:exact_synonym: methyl 3-(4-{[(2S)-2-hydroxy-3-(propan-2-ylamino)propyl]oxy}phenyl)propanoate
 related_synonym: Formula=C16H25NO4;   InChI=1S/C16H25NO4/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3/t14-/m0/s1;   InChIKey=AQNDDEOPVVGCPG-AWEZNQCLSA-N;   SMILES=COC(=O)CCc1ccc(OC[C@@H](O)CNC(C)C)cc1
 xref: PMID:15135097;   PMID:15163527;   PMID:20708984;   PMID:25105423;   Reaxys:21507231
 cyclic_relationship: is_enantiomer_of CHEBI:60074


show annotations for term's descendants       view all columns           Sort by:
 
esmolol term browser
Symbol Object Name JBrowse Chr Start Stop Reference
G Abcb4 ATP binding cassette subfamily B member 4 JBrowse link 4 22,133,984 22,192,687 RGD:6480464
G Hmox1 heme oxygenase 1 JBrowse link 19 14,508,634 14,515,455 RGD:6480464
G Ren renin JBrowse link 13 50,502,724 50,513,953 RGD:6480464

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19770
    role 19717
      application 19366
        fuel 10355
          methanol 3063
            methyl ester 3052
              methyl 3-\{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl\}propanoate 3
                (S)-esmolol 3
                  esmolol + 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19770
    subatomic particle 19768
      composite particle 19768
        hadron 19768
          baryon 19768
            nucleon 19768
              atomic nucleus 19768
                atom 19768
                  main group element atom 19653
                    main group molecular entity 19653
                      s-block molecular entity 19415
                        hydrogen molecular entity 19404
                          hydrides 18360
                            inorganic hydride 17215
                              pnictogen hydride 17178
                                nitrogen hydride 17012
                                  azane 16707
                                    ammonia 16706
                                      organic amino compound 16705
                                        amino alcohol 880
                                          ethanolamines 765
                                            3-\{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl\}propanoic acid 3
                                              methyl 3-\{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl\}propanoate 3
                                                (S)-esmolol 3
                                                  esmolol + 3
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.