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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:Naphthgeranine B
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Accession:CHEBI:219672 term browser browse the term
Synonyms:exact_synonym: (4aS,12bR)-8,10-dihydroxy-2-(hydroxymethyl)-5,5-dimethyl-3,4,4a,12b-tetrahydronaphtho[2,3-c]isochromene-7,12-dione
 related_synonym: Formula=C20H20O6;   InChI=1S/C20H20O6/c1-20(2)13-4-3-9(8-21)5-11(13)16-17(24)12-6-10(22)7-14(23)15(12)18(25)19(16)26-20/h5-7,11,13,21-23H,3-4,8H2,1-2H3/t11-,13+/m1/s1;   InChIKey=PTWDQKQKJHACJW-YPMHNXCESA-N;   SMILES=O=C1C=2OC([C@H]3CCC(=C[C@H]3C2C(=O)C=4C1=C(O)C=C(O)C4)CO)(C)C
 xref: Chemspider:116629


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 26089
    chemical entity 26068
      atom 26064
        nonmetal atom 25556
          oxygen atom 24812
            oxygen molecular entity 24852
              organooxygen compound 24093
                Naphthgeranine B 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26089
    subatomic particle 26064
      composite particle 26064
        hadron 26064
          baryon 26064
            nucleon 26016
              atomic nucleus 26064
                atom 26064
                  main group element atom 25891
                    p-block element atom 25891
                      carbon group element atom 25478
                        carbon atom 25437
                          organic molecular entity 25437
                            organic molecule 25250
                              organic cyclic compound 24298
                                organic heterocyclic compound 22333
                                  organic heteropolycyclic compound 21334
                                    organic heterotricyclic compound 16005
                                      Naphthgeranine B 0
paths to the root