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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:feruloylagmatine
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Accession:CHEBI:75544 term browser browse the term
Definition:A member of the class of cinnamamides obtained by formal condensation of the carboxy group of ferulic acid with the amino group of agmatine.
Synonyms:exact_synonym: (2E)-N-(4-carbamimidamidobutyl)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enamide
 related_synonym: 1-(trans-4'-hydroxy-3'-methoxycinnamoylamino)-4-guanidinobutane;   Formula=C15H22N4O3;   InChI=1S/C15H22N4O3/c1-22-13-10-11(4-6-12(13)20)5-7-14(21)18-8-2-3-9-19-15(16)17/h4-7,10,20H,2-3,8-9H2,1H3,(H,18,21)(H4,16,17,19)/b7-5+;   InChIKey=UBMDAKWARMURDL-FNORWQNLSA-N;   N1-trans-Feruloylagmatine;   SMILES=COc1cc(\\C=C\\C(=O)NCCCCNC(N)=N)ccc1O
 xref: HMDB:HMDB0037107;   KEGG:C18325;   MetaCyc:CPD-12236;   PMID:10993146;   PMID:18270436;   PMID:18649321;   PMID:19521717;   Reaxys:7650492


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Path 1
Term Annotations click to browse term
  CHEBI ontology 26435
    role 26267
      chemical role 24347
        antioxidant 17519
          ferulic acid 1036
            feruloylagmatine 0
              hordatine B 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26435
    subatomic particle 26411
      composite particle 26411
        hadron 26411
          baryon 26411
            nucleon 26411
              atomic nucleus 26411
                atom 26411
                  main group element atom 26157
                    p-block element atom 26157
                      carbon group element atom 25593
                        carbon atom 25556
                          organic molecular entity 25556
                            heteroorganic entity 24943
                              organochalcogen compound 24537
                                organooxygen compound 24127
                                  carbon oxoacid 22798
                                    carboxylic acid 22778
                                      carboacyl group 20066
                                        univalent carboacyl group 20066
                                          carbamoyl group 19588
                                            carboxamide 19588
                                              alpha,beta-unsaturated carboxylic acid amide 7583
                                                enamide 7583
                                                  cinnamamides 1426
                                                    4-hydroxy-3-methoxycinnamoylagmatine 0
                                                      feruloylagmatine 0
                                                        hordatine B 0
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