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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:suberosin
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Accession:CHEBI:69041 term browser browse the term
Definition:A member of the class of coumarins in which the coumarin ring is substituted at positions 6 and 7 by a 3-methylbut-2-en-1-yl group and a methoxy group, respectively. A natural product found in Citropsis articulata.
Synonyms:exact_synonym: 7-methoxy-6-(3-methylbut-2-en-1-yl)-2H-chromen-2-one
 related_synonym: 7-Methoxy-6-(3-methyl-2-buten-1-yl)-2H-chromen-2-one;   7-methoxy-6-prenylcoumarin;   Formula=C15H16O3;   InChI=1S/C15H16O3/c1-10(2)4-5-11-8-12-6-7-15(16)18-14(12)9-13(11)17-3/h4,6-9H,5H2,1-3H3;   InChIKey=RSZDAYHEZSRVHS-UHFFFAOYSA-N;   SMILES=C1=2OC(=O)C=CC1=CC(=C(C2)OC)CC=C(C)C
 xref: CAS:581-31-7;   KNApSAcK:C00037864;   PMID:17179947;   PMID:21985060;   PMID:25017518;   Reaxys:199431


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  CHEBI ontology 19816
    role 19764
      application 19426
        pharmaceutical 19301
          drug 19301
            hematologic agent 4367
              anticoagulant 4161
                suberosin 0
Path 2
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  CHEBI ontology 19816
    subatomic particle 19814
      composite particle 19814
        hadron 19814
          baryon 19814
            nucleon 19814
              atomic nucleus 19814
                atom 19814
                  main group element atom 19702
                    p-block element atom 19702
                      carbon group element atom 19608
                        carbon atom 19597
                          organic molecular entity 19597
                            organic molecule 19522
                              organic cyclic compound 19320
                                organic heterocyclic compound 18432
                                  oxacycle 17200
                                    benzopyran 10142
                                      1-benzopyran 9858
                                        chromenes 932
                                          chromenone 853
                                            coumarins 574
                                              hydroxycoumarin 301
                                                7-demethylsuberosin 0
                                                  suberosin 0
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