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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:beta-lapachone
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Accession:CHEBI:10429 term browser browse the term
Definition:A benzochromenone that is 3,4-dihydro-2H-benzo[h]chromene-5,6-dione substituted by geminal methyl groups at position 2. Isolated from Tabebuia avellanedae, it exhibits antineoplastic and anti-inflammatory activities.
Synonyms:exact_synonym: 2,2-dimethyl-3,4-dihydro-2H-benzo[h]chromene-5,6-dione
 related_synonym: 3,4-dihydro-2,2-dimethyl-2H-naphtho(1,2-b)pyran-5,6-dione;   ARQ 501;   Formula=C15H14O3;   InChI=1S/C15H14O3/c1-15(2)8-7-11-13(17)12(16)9-5-3-4-6-10(9)14(11)18-15/h3-6H,7-8H2,1-2H3;   InChIKey=QZPQTZZNNJUOLS-UHFFFAOYSA-N;   SMILES=CC1(C)CCC2=C(O1)c1ccccc1C(=O)C2=O;   beta-lap
 alt_id: CHEBI:66546
 xref: CAS:4707-32-8;   KEGG:C10367;   KNApSAcK:C00002836
 xref_mesh: MESH:C014638
 xref: PMID:16822200;   PMID:16891723;   PMID:18180274;   PMID:18227145;   PMID:18424157;   PMID:18706870;   PMID:19051226;   PMID:22560628;   PMID:22736525;   PMID:23010281;   PMID:23071729;   PMID:23865001;   PMID:25448047;   PMID:26328485;   PMID:3652040;   PMID:6704108;   Reaxys:181499


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    Path 1
    Term Annotations click to browse term
      CHEBI ontology 19890
        role 19839
          application 19703
            anti-inflammatory agent 16700
              beta-lapachone 3211
    Path 2
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      CHEBI ontology 19890
        subatomic particle 19867
          composite particle 19888
            hadron 19888
              baryon 19888
                nucleon 19867
                  atomic nucleus 19888
                    atom 19888
                      main group element atom 19806
                        p-block element atom 19806
                          p-block molecular entity 19806
                            carbon group molecular entity 19766
                              organic molecular entity 19743
                                heteroorganic entity 19502
                                  organochalcogen compound 19264
                                    organooxygen compound 19180
                                      carbonyl compound 18920
                                        ketone 17269
                                          cyclic ketone 15901
                                            quinone 9905
                                              orthoquinones 3273
                                                beta-lapachone 3211
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