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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:michaolide I
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Accession:CHEBI:66382 term browser browse the term
Definition:A cembrane diterpenoid with cytotoxic activity isolated from the soft coral Lobophytum michaelae.
Synonyms:exact_synonym: (3aR,4R,6E,9S,10E,13R,14R,15S,15aS)-14,15-dihydroxy-6,10,14-trimethyl-3-methylidene-2-oxo-2,3,3a,4,5,8,9,12,13,14,15,15a-dodecahydrocyclotetradeca[b]furan-4,9,13-triyl triacetate
 related_synonym: Formula=C26H36O10;   InChI=1S/C26H36O10/c1-13-8-10-19(33-16(4)27)14(2)9-11-21(35-18(6)29)26(7,32)24(30)23-22(15(3)25(31)36-23)20(12-13)34-17(5)28/h8-9,19-24,30,32H,3,10-12H2,1-2,4-7H3/b13-8+,14-9+/t19-,20+,21+,22+,23-,24-,26-/m0/s1;   InChIKey=HSXKORWNAMLPAT-DHJPSPATSA-N;   SMILES=[H][C@]12OC(=O)C(=C)[C@]1([H])[C@@H](C\\C(C)=C\\C[C@H](OC(C)=O)\\C(C)=C\\C[C@@H](OC(C)=O)[C@](C)(O)[C@H]2O)OC(C)=O
 xref: PMID:17473465;   Reaxys:11101579


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Path 1
Term Annotations click to browse term
  CHEBI ontology 26046
    role 25962
      application 25183
        pharmaceutical 24557
          drug 24554
            antineoplastic agent 20864
              michaolide I 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 26046
    subatomic particle 26021
      composite particle 26021
        hadron 26021
          baryon 26021
            nucleon 26021
              atomic nucleus 26021
                atom 26021
                  main group element atom 25846
                    p-block element atom 25846
                      carbon group element atom 25443
                        carbon atom 25401
                          organic molecular entity 25401
                            heteroorganic entity 24779
                              organochalcogen compound 24391
                                organooxygen compound 24069
                                  carbon oxoacid 22771
                                    carboxylic acid 22751
                                      monocarboxylic acid 21758
                                        acetic acid 11431
                                          acetate ester 4181
                                            michaolide I 0
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