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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:carmoxirole
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Accession:CHEBI:64200 term browser browse the term
Definition:An indolecarboxylic acid that is indole-5-carboxylic acid bearing an additional 4-(4-phenyl-1,2,3,6-tetrahydropyridin-1-yl)butyl substituent at position 3. Selective, peripherally acting dopamine D2 receptor agonist. Modulates noradrenalin release and sympathetic activation. Displays antihypertensive properties in vivo.
Synonyms:exact_synonym: 3-[4-(4-phenyl-3,6-dihydropyridin-1(2H)-yl)butyl]-1H-indole-5-carboxylic acid
 related_synonym: 3-(4-(3,6-Dihydro-4-phenyl-1(2H)-pyridyl)butyl)indole-5-carboxylic acid;   Formula=C24H26N2O2;   InChI=1S/C24H26N2O2/c27-24(28)20-9-10-23-22(16-20)21(17-25-23)8-4-5-13-26-14-11-19(12-15-26)18-6-2-1-3-7-18/h1-3,6-7,9-11,16-17,25H,4-5,8,12-15H2,(H,27,28);   InChIKey=AFSOIHMEOKEZJF-UHFFFAOYSA-N;   SMILES=OC(=O)c1ccc2[nH]cc(CCCCN3CCC(=CC3)c3ccccc3)c2c1;   carmoxirol;   carmoxirolum
 xref: CAS:98323-83-2;   LINCS:LSM-3850
 xref_mesh: MESH:C071485
 xref: PMID:10099036;   PMID:12106810;   PMID:1352381;   PMID:1356782;   PMID:1356783;   PMID:15109678;   PMID:1682817;   PMID:22051191;   PMID:7757314;   PMID:7902890;   PMID:8097997;   PMID:9825185;   Patent:DE3342632;   Patent:EP0548635;   Patent:US5256673;   Reaxys:5772553
 cyclic_relationship: is_conjugate_base_of CHEBI:64201


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  CHEBI ontology 0
    role 0
      application 0
        pharmaceutical 0
          drug 0
            cardiovascular drug 0
              antihypertensive agent 0
                carmoxirole 0
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  CHEBI ontology 0
    subatomic particle 0
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        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteropolycyclic compound 0
                                    organic heterobicyclic compound 0
                                      benzopyrrole 0
                                        indoles 0
                                          indolecarboxylic acid 0
                                            carmoxirole 0
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