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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:yanuthone J
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Accession:CHEBI:133838 term browser browse the term
Definition:A class I yanuthone that is yanuthone E in which the sesquiterpenoid double bond furthest from the epoxycyclohexenone ring has undergone formal addition of water to give the corresponding tertiary alcohol.
Synonyms:exact_synonym: 3-hydroxy-5-({(1R,2R,6R)-2-hydroxy-6-[(2E,6E)-11-hydroxy-3,7,11-trimethyldodeca-2,6-dien-1-yl]-5-oxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl}methoxy)-3-methyl-5-oxopentanoic acid
 related_synonym: Formula=C28H42O9;   InChI=1S/C28H42O9/c1-18(10-7-12-26(3,4)34)8-6-9-19(2)11-13-28-21(29)14-20(24(33)25(28)37-28)17-36-23(32)16-27(5,35)15-22(30)31/h8,11,14,24-25,33-35H,6-7,9-10,12-13,15-17H2,1-5H3,(H,30,31)/b18-8+,19-11+/t24-,25-,27?,28+/m1/s1;   InChIKey=HMSKAMXAOALZEP-LXRXXDTASA-N;   SMILES=C/C(=C\\CC\\C(\\C)=C\\C[C@]12C(C=C([C@H]([C@H]1O2)O)COC(CC(CC(O)=O)(O)C)=O)=O)/CCCC(C)(C)O
 xref: PMID:24684908;   PMID:25293978;   Reaxys:27020145


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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          antimetabolite 0
            3-hydroxy-3-methylglutaric acid 0
              yanuthone J 0
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Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbonyl compound 0
                                    ketone 0
                                      cyclic ketone 0
                                        alicyclic ketone 0
                                          cyclohexenones 0
                                            yanuthones 0
                                              class I yanuthone 0
                                                7-deacetoxyyanuthone A 0
                                                  22-deacetylyanuthone A 0
                                                    yanuthone E 0
                                                      yanuthone J 0
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