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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:Plicatilisin C
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Accession:CHEBI:207188 term browser browse the term
Synonyms:exact_synonym: (1R,2R,3R,3aR,5aS)-9-(hydroxymethyl)-3a,5a-dimethyl-3-propan-2-yl-1,2,3,4,5,6,7,8-octahydrobenzo[g]azulene-1,2-diol
 related_synonym: Formula=C20H32O3;   InChI=1S/C20H32O3/c1-12(2)16-18(23)17(22)15-10-14-13(11-21)6-5-7-19(14,3)8-9-20(15,16)4/h10,12,16-18,21-23H,5-9,11H2,1-4H3/t16-,17+,18+,19-,20-/m0/s1;   InChIKey=MINQDQAGQOTQDE-MDMHHNQBSA-N;   SMILES=O[C@@H]1C2=CC3=C(CCC[C@@]3(C)CC[C@]2(C)[C@H]([C@H]1O)C(C)C)CO
 xref: Chemspider:28516054

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  CHEBI ontology 0
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        polyatomic entity 0
          heteroatomic molecular entity 0
            hydroxides 0
              organic hydroxy compound 0
                Plicatilisin C 0
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  CHEBI ontology 0
    subatomic particle 0
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              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      p-block molecular entity 0
                        chalcogen molecular entity 0
                          oxygen molecular entity 0
                            hydroxides 0
                              organic hydroxy compound 0
                                Plicatilisin C 0
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