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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:cadabicine sulfate
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Accession:CHEBI:132716 term browser browse the term
Definition:A spermidine alkaloid with formula C25H29N3O7S that is biosynthesised by Arabidopsis thaliana.
Synonyms:exact_synonym: (8E,22E)-10,21-dioxo-2-oxa-11,16,20-triazatricyclo[22.2.2.1(3,7)]nonacosa-1(26),3(29),4,6,8,22,24,27-octaen-4-yl hydrogen sulfate
 related_synonym: Formula=C25H29N3O7S;   InChI=1S/C25H29N3O7S/c29-24-12-7-19-4-9-21(10-5-19)34-23-18-20(6-11-22(23)35-36(31,32)33)8-13-25(30)27-16-2-1-14-26-15-3-17-28-24/h4-13,18,26H,1-3,14-17H2,(H,27,30)(H,28,29)(H,31,32,33)/b12-7+,13-8+;   InChIKey=HVFBFUUUEIXKJL-INOXDZRUSA-N;   SMILES=N1CCCNCCCCNC(C=CC=2C=C(C(=CC2)OS(O)(=O)=O)OC=3C=CC(=CC3)C=CC1=O)=O;   cyclic didehydro-di(coumaroyl)spermidine sulfate;   didehydro-di(coumaroyl) spermidine sulfate
 xref: PMID:27363486


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Path 1
Term Annotations click to browse term
  CHEBI ontology 24485
    role 24397
      biological role 24364
        biochemical role 23779
          metabolite 23702
            alkaloid 5818
              spermidine alkaloid 0
                cadabicine sulfate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 24485
    subatomic particle 24442
      composite particle 24442
        hadron 24442
          baryon 24442
            nucleon 24442
              atomic nucleus 24442
                atom 24442
                  main group element atom 24300
                    p-block element atom 24300
                      carbon group element atom 24084
                        carbon atom 24047
                          organic molecular entity 24047
                            organic group 22411
                              organic divalent group 22388
                                organodiyl group 22388
                                  carbonyl group 22373
                                    carbonyl compound 22373
                                      carboxylic acid 21372
                                        monocarboxylic acid 20334
                                          alpha,beta-unsaturated monocarboxylic acid 12871
                                            cinnamic acids 2468
                                              hydroxycinnamic acid 1274
                                                monohydroxycinnamic acid 942
                                                  coumaric acid 30
                                                    4-coumaric acid 30
                                                      cadabicine sulfate 0
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