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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:nitrendipine
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Accession:CHEBI:7582 term browser browse the term
Definition:A dihydropyridine that is 1,4-dihydropyridine substituted by methyl groups at positions 2 and 6, a 3-nitrophenyl group at position 4, a ethoxycarbonyl group at position 3 and a methoxycarbonyl group at position 5. It is a calcium-channel blocker used in the treatment of hypertension.
Synonyms:exact_synonym: ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
 related_synonym: 1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid ethyl methyl ester;   BAY e 5009;   Bayotensin;   Baypress;   Bylotensin;   Deiten;   Formula=C18H20N2O6;   InChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3;   InChIKey=PVHUJELLJLJGLN-UHFFFAOYSA-N;   Nidrel;   SMILES=CCOC(=O)C1=C(C)NC(C)=C(C1c1cccc(c1)[N+]([O-])=O)C(=O)OC;   nitrendipino;   nitrendipinum
 xref: CAS:39562-70-4;   DrugBank:DB01054;   Drug_Central:1947;   HMDB:HMDB0015187;   KEGG:C07713;   KEGG:D00629;   LINCS:LSM-1246
 xref_mesh: MESH:D009568
 xref: PMID:1725797;   PMID:1790544;   PMID:20398559;   PMID:21811924;   PMID:23648675;   PMID:24134630;   PMID:6085389;   Patent:CN101416954;   Patent:DE2117571;   Patent:US3799934;   Reaxys:498823;   Wikipedia:Nitrendipine

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  CHEBI ontology 0
    role 0
      application 0
        fuel 0
          methanol 0
            methyl ester 0
              nitrendipine 0
Path 2
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      chalcogen 0
                        oxygen atom 0
                          oxygen molecular entity 0
                            hydroxides 0
                              organic hydroxy compound 0
                                alcohol 0
                                  primary alcohol 0
                                    ethanols 0
                                      ethanol 0
                                        ethyl ester 0
                                          nitrendipine 0
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