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Accession:CHEBI:17340 term browser browse the term
Definition:A cyclohexanecarboxylate ester that consists of 4-(2-carboxyethyl)phenyl cyclohexanecarboxylate bearing an aminomethyl substituent at the 4-position.
Synonyms:exact_synonym: 3-[4-({[(1r,4r)-4-(aminomethyl)cyclohexyl]carbonyl}oxy)phenyl]propanoic acid
 related_synonym: 3-[4-({[trans-4-(aminomethyl)cyclohexyl]carbonyl}oxy)phenyl]propanoic acid;   Formula=C17H23NO4;   InChI=1S/C17H23NO4/c18-11-13-1-6-14(7-2-13)17(21)22-15-8-3-12(4-9-15)5-10-16(19)20/h3-4,8-9,13-14H,1-2,5-7,10-11,18H2,(H,19,20)/t13-,14-;   InChIKey=FHRSHSOEWXUORL-HDJSIYSDSA-N;   SMILES=NC[C@H]1CC[C@@H](CC1)C(=O)Oc1ccc(CCC(O)=O)cc1;   p-hydroxyhydrocinnamic acid trans-(4-aminomethyl)cyclohexanecarboxylate;   trans-4-(((4-(aminomethyl)cyclohexyl)carbonyl)oxy)benzenepropanoic acid
 alt_id: CHEBI:13957;   CHEBI:23082;   CHEBI:3563
 xref: Beilstein:2820321 "ChemIDplus";   CAS:34675-84-8 "ChemIDplus";   Drug_Central:582 "DrugCentral";   KEGG:C01564;   KEGG:D07663;   PMID:1003703 "Europe PMC";   PMID:12436309 "Europe PMC";   PMID:15099451 "Europe PMC";   PMID:17323190 "Europe PMC";   PMID:3367546 "Europe PMC";   PMID:3435599 "Europe PMC";   PMID:4029808 "Europe PMC";   PMID:8020637 "Europe PMC";   PMID:8350665 "Europe PMC";   PMID:8871449 "Europe PMC";   Reaxys:2820321 "Reaxys";   Wikipedia:Cetraxate
 cyclic_relationship: is_tautomer_of CHEBI:58112

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  CHEBI ontology 19754
    role 19701
      application 19353
        pharmaceutical 19222
          drug 19222
            cetraxates 0
              cetraxate 0
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  CHEBI ontology 19754
    subatomic particle 19752
      composite particle 19752
        hadron 19752
          baryon 19752
            nucleon 19752
              atomic nucleus 19752
                atom 19752
                  main group element atom 19637
                    p-block element atom 19637
                      carbon group element atom 19528
                        carbon atom 19517
                          organic molecular entity 19517
                            organic group 18422
                              organic divalent group 18414
                                organodiyl group 18414
                                  carbonyl group 18303
                                    carbonyl compound 18303
                                      carboxylic acid 17971
                                        monocarboxylic acid 17286
                                          cyclohexanecarboxylic acid 9
                                            cyclohexanecarboxylate ester 0
                                              cetraxates 0
                                                cetraxate 0
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