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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:Spiroxanthoquinodin B
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Accession:CHEBI:215716 term browser browse the term
Synonyms:exact_synonym: dimethyl (1S,1'S,2S,3R,12'R,12'aS)-1,3,5,7',8',12'-hexahydroxy-7-methyl-4,9'-dioxospiro[1,3-dihydronaphthalene-2,4'-5,10,11,12-tetrahydro-1H-cyclohepta[c]xanthene]-1',12'a-dicarboxylate
 related_synonym: Formula=C32H30O13;   InChI=1S/C32H30O13/c1-12-8-15-21(17(34)9-12)25(38)28(40)31(27(15)39)7-6-14(29(41)43-2)20-13(11-31)10-18(35)22-24(37)23-16(33)4-5-19(36)32(23,30(42)44-3)45-26(20)22/h6-10,14,19,27-28,34-37,39-40H,4-5,11H2,1-3H3/t14-,19+,27-,28-,31+,32+/m0/s1;   InChIKey=VNIZAJZTVLZYGC-VRCXXQDVSA-N;   SMILES=O=C1C2=C(O)C=C(C)C=C2[C@H](O)[C@@]3([C@H]1O)C=C[C@H](C(=O)OC)C4=C(C3)C=C(O)C5=C4O[C@]6(C(C(=O)CC[C@H]6O)=C5O)C(=O)OC
 xref: Chemspider:78442182


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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 24852
            oxygen molecular entity 24852
              organooxygen compound 24093
                oxacycle 20040
                  dibenzopyran 288
                    xanthenes 282
                      Spiroxanthoquinodin B 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26089
    subatomic particle 26064
      composite particle 26064
        hadron 26064
          baryon 26064
            nucleon 26064
              atomic nucleus 26064
                atom 26064
                  main group element atom 25891
                    main group molecular entity 25891
                      p-block molecular entity 25886
                        carbon group molecular entity 25478
                          organic molecular entity 25437
                            organic molecule 25250
                              organic cyclic compound 24298
                                organic heterocyclic compound 22334
                                  organic heteropolycyclic compound 21333
                                    dibenzopyran 288
                                      xanthenes 282
                                        Spiroxanthoquinodin B 0
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