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ONTOLOGY REPORT - ANNOTATIONS


Term:esmolol hydrochloride
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Accession:CHEBI:4857 term browser browse the term
Definition:The hydrochloride salt of esmolol. A cardioselective and short-acting beta1 receptor blocker with rapid onset but lacking intrinsic sympathomimetic and membrane-stabilising properties, it is used in the management of supraventricular arrhythmias, and for the control of hypertension and tachycardia during surgery.
Synonyms:exact_synonym: 2-hydroxy-3-[4-(3-methoxy-3-oxopropyl)phenoxy]-N-(propan-2-yl)propan-1-aminium chloride
 related_synonym: 4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoic acid methyl ester HCl;   4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoic acid methyl ester hydrochloride;   Formula=C16H26ClNO4;   InChI=1S/C16H25NO4.ClH/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;1H;   InChIKey=GEKNCWBANDDJJL-UHFFFAOYSA-N;   SMILES=[Cl-].COC(=O)CCc1ccc(OCC(O)C[NH2+]C(C)C)cc1;   esmolol HCl;   methyl 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoate hydrochloride;   methyl p-(2-hydroxy-3-(isopropylamino)propoxy)hydrocinnamate hydrochloride
 xref: Beilstein:5185568 "Beilstein";   CAS:81161-17-3 "ChemIDplus";   CAS:81161-17-3 "KEGG DRUG";   DrugBank:DB00187;   KEGG:D00644;   PMID:1642945 "Europe PMC"


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19764
    chemical entity 19763
      chemical substance 11490
        mixture 10810
          racemate 9688
            esmolol 3
              esmolol hydrochloride 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
                    main group molecular entity 19646
                      s-block molecular entity 19408
                        hydrogen molecular entity 19397
                          hydrides 18356
                            inorganic hydride 17210
                              pnictogen hydride 17174
                                nitrogen hydride 17008
                                  azane 16701
                                    ammonia 16698
                                      organic amino compound 16697
                                        amino alcohol 867
                                          ethanolamines 758
                                            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
                                                    esmolol hydrochloride 0
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