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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:13-Hydroxy-5'-O-methylmelledonal
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Accession:CHEBI:168896 term browser browse the term
Synonyms:exact_synonym: [3-ormyl-2a,4a,7-trihydroxy-6-(hydroxymethyl)-6,7b-dimethyl-2,5,7,7a-tetrahydro-1H-cyclobuta[e]inden-2-yl] 2-hydroxy-4-methoxy-6-methylbenzoate
 related_synonym: Formula=C24H30O9;   InChI=1S/C24H30O9/c1-12-5-14(32-4)6-15(27)17(12)20(29)33-16-8-22(3)18-19(28)21(2,11-26)10-23(18,30)7-13(9-25)24(16,22)31/h5-7,9,16,18-19,26-28,30-31H,8,10-11H2,1-4H3;   InChIKey=GEZFFZYSQRTAPC-UHFFFAOYSA-N;   SMILES=OC12C(C3C(O)(CC(C3O)(CO)C)C=C1C=O)(CC2OC(=O)C=4C(=CC(OC)=CC4O)C)C
 xref: Chemspider:35014037;   HMDB:HMDB0035864


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19893
    chemical entity 19891
      atom 19891
        nonmetal atom 19814
          carbon atom 19767
            organic molecular entity 19767
              isoprenoid 14081
                terpenoid 13781
                  sesquiterpenoid 3289
                    13-Hydroxy-5'-O-methylmelledonal 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19893
    subatomic particle 19891
      composite particle 19891
        hadron 19891
          baryon 19891
            nucleon 19891
              atomic nucleus 19891
                atom 19891
                  main group element atom 19830
                    p-block element atom 19830
                      carbon group element atom 19771
                        carbon atom 19767
                          organic molecular entity 19767
                            heteroorganic entity 19525
                              organochalcogen compound 19286
                                organooxygen compound 19202
                                  carbon oxoacid 18668
                                    carboxylic acid 18665
                                      aromatic carboxylic acid 12751
                                        benzoic acids 12729
                                          benzoate ester 5748
                                            13-Hydroxy-5'-O-methylmelledonal 0
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