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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:dehydrocostus lactone
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Accession:CHEBI:244418 term browser browse the term
Definition:An organic heterotricyclic compound and guaianolide sesquiterpene lactone that is acrylic acid which is substituted at position 2 by a 4-hydroxy-3,8-bis(methylene)decahydoazulen-5-yl group and in which the hydroxy group and the carboxy group have undergone formal condensation to afford the corresponding gamma-lactone.
Synonyms:exact_synonym: (3aR,6aS,9aS,9bR)-3,6,9-tris(methylene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione;   (3aR,6aS,9aS,9bR)-3,6,9-tris(methylidene)octahydroazuleno[4,5-b]furan-2,8(3H,4H)-dione
 related_synonym: (3aS,6aR,9aR,9bS)-decahydro-3,6,9-tris(methylene)azuleno[4,5-b]furan-2(3H)-one;   Formula=C15H18O2;   InChI=1S/C15H18O2/c1-8-4-7-12-10(3)15(16)17-14(12)13-9(2)5-6-11(8)13/h11-14H,1-7H2/t11-,12-,13-,14-/m0/s1;   InChIKey=NETSQGRTUNRXEO-XUXIUFHCSA-N;   SMILES=[H][C@@]12CCC(=C)[C@]1([H])[C@H]1OC(=O)C(=C)[C@@H]1CCC2=C;   dehydrocostuslactone
 alt_id: CHEBI:4359;   CHEBI:467325
 xref: Beilstein:4733740;   CAS:477-43-0;   KEGG:C09387;   KNApSAcK:C00003245
 xref_mesh: MESH:C083030
 xref: PMID:10193198;   PMID:12419922;   PMID:14192430;   PMID:15209353;   PMID:15881118;   PMID:17391667;   PMID:19148545;   PMID:19188481;   PMID:19457452;   PMID:19700217;   PMID:21353686;   PMID:21472220;   PMID:21596031;   PMID:22359572;   PMID:23047249;   PMID:6476889;   PMID:8541643;   PMID:9784148;   PMID:9917276;   Patent:CN102058579;   Reaxys:4733740


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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            dehydrocostus lactone 0
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  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
                                  ester 0
                                    carboxylic ester 0
                                      lactone 0
                                        terpene lactone 0
                                          sesquiterpene lactone 0
                                            dehydrocostus lactone 0
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