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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:14-hydroxydihydromelleolide
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Accession:CHEBI:204546 term browser browse the term
Synonyms:exact_synonym: [(2R,2aS,4aS,6S,7bR)-2a-hydroxy-3,6-bis(hydroxymethyl)-6,7b-dimethyl-1,2,4a,5,7,7a-hexahydrocyclobuta[e]inden-2-yl] 2,4-dihydroxy-6-methylbenzoate
 related_synonym: Formula=C23H30O7;   InChI=1S/C23H30O7/c1-12-4-15(26)6-17(27)19(12)20(28)30-18-9-22(3)16-8-21(2,11-25)7-13(16)5-14(10-24)23(18,22)29/h4-6,13,16,18,24-27,29H,7-11H2,1-3H3/t13-,16?,18-,21+,22-,23+/m1/s1;   InChIKey=HDGURVCSOJDUHT-GJQGFOMNSA-N;   SMILES=O=C(O[C@H]1[C@@]2(O)C(=C[C@@H]3C[C@@](CC3[C@@]2(C)C1)(CO)C)CO)C4=C(O)C=C(O)C=C4C
 xref: Chemspider:78437154



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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22208
    chemical entity 22207
      atom 22200
        nonmetal atom 22085
          carbon atom 21857
            organic molecular entity 21857
              isoprenoid 14785
                terpenoid 14478
                  sesquiterpenoid 3280
                    14-hydroxydihydromelleolide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22208
    subatomic particle 22200
      composite particle 22200
        hadron 22200
          baryon 22200
            nucleon 22200
              atomic nucleus 22200
                atom 22200
                  main group element atom 22134
                    p-block element atom 22134
                      carbon group element atom 21931
                        carbon atom 21857
                          organic molecular entity 21857
                            heteroorganic entity 21513
                              organochalcogen compound 21003
                                organooxygen compound 20847
                                  carbon oxoacid 19639
                                    carboxylic acid 19635
                                      aromatic carboxylic acid 12792
                                        benzoic acids 12770
                                          benzoate ester 5535
                                            14-hydroxydihydromelleolide 0
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