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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:(E)-p-coumaroylagmatine
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Accession:CHEBI:86080 term browser browse the term
Definition:A p-coumaroylagmatine(1+) in which the double bond of the coumaroyl component has E-geochemistry.
Synonyms:exact_synonym: (2E)-N-[4-(carbamimidamido)butyl]-3-(4-hydroxyphenyl)prop-2-enamide
 related_synonym: (E)-N-(4-guanidinobutyl)-4-hydroxycinnamamide;   (E)-coumaroylagmatine;   1-(trans-4'-hydroxycinnamoylamino)-4-guanidinobutane;   Formula=C14H20N4O2;   InChI=1S/C14H20N4O2/c15-14(16)18-10-2-1-9-17-13(20)8-5-11-3-6-12(19)7-4-11/h3-8,19H,1-2,9-10H2,(H,17,20)(H4,15,16,18)/b8-5+;   InChIKey=AKIHYQWCLCDMMI-VMPITWQZSA-N;   SMILES=NC(=N)NCCCCNC(=O)\\C=C\\c1ccc(O)cc1;   trans-coumaroylagmatine;   trans-p-coumaroylagmatine
 xref: Reaxys:6893419
 cyclic_relationship: is_conjugate_base_of CHEBI:86078


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19811
    role 19818
      biological role 19785
        physiological role 19784
          food component 19784
            trans-4-coumaric acid 0
              (E)-p-coumaroylagmatine 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      carbon group element atom 19708
                        carbon atom 19734
                          organic molecular entity 19705
                            heteroorganic entity 19459
                              organochalcogen compound 19222
                                organooxygen compound 19137
                                  carbon oxoacid 18597
                                    carboxylic acid 18594
                                      monocarboxylic acid 17952
                                        alpha,beta-unsaturated monocarboxylic acid 13440
                                          cinnamic acids 2510
                                            hydroxycinnamic acid 1364
                                              monohydroxycinnamic acid 1021
                                                coumaric acid 39
                                                  4-coumaric acid 39
                                                    trans-4-coumaric acid 0
                                                      (E)-p-coumaroylagmatine 0
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