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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:4-[6-(diaminomethylideneamino)-1-oxohexoxy]benzoic acid ethyl ester
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Accession:CHEBI:93036 term browser browse the term
Definition:A benzoate ester that has formula C16H23N3O4.
Synonyms:related_synonym: Formula=C16H23N3O4;   InChI=1S/C16H23N3O4/c1-2-22-15(21)12-7-9-13(10-8-12)23-14(20)6-4-3-5-11-19-16(17)18/h7-10H,2-6,11H2,1H3,(H4,17,18,19);   InChIKey=YKGYIDJEEQRWQH-UHFFFAOYSA-N;   SMILES=CCOC(=O)C1=CC=C(C=C1)OC(=O)CCCCCN=C(N)N;   gabexate mesilate;   gabexate mesylate
 xref: CAS:39492-01-8;   Drug_Central:3257;   LINCS:LSM-3314
 xref_mesh: MESH:D016670

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Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      group 0
        inorganic group 0
          oxo group 0
            organic oxo compound 0
              carbonyl compound 0
                carboxylic ester 0
                  benzoate ester 0
                    4-[6-(diaminomethylideneamino)-1-oxohexoxy]benzoic acid ethyl ester 0
Path 2
Term Annotations click to browse term
  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
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      aromatic carboxylic acid 0
                                        benzoic acids 0
                                          benzoate ester 0
                                            4-[6-(diaminomethylideneamino)-1-oxohexoxy]benzoic acid ethyl ester 0
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