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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:17-dimethylaminolobohedleolide
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Accession:CHEBI:66587 term browser browse the term
Definition:A cembrane diterpenoid isolated from Lobophytum and shown to have anti-HIV-1 activity.
Synonyms:exact_synonym: (3R,3aS,6E,10E,14E,15aR)-3-[(dimethylamino)methyl]-6,14-dimethyl-2-oxo-2,3,3a,4,5,8,9,12,13,15a-decahydrocyclotetradeca[b]furan-10-carboxylic acid
 related_synonym: Formula=C22H33NO4;   InChI=1S/C22H33NO4/c1-15-7-5-9-17(21(24)25)10-6-8-16(2)13-20-18(12-11-15)19(14-23(3)4)22(26)27-20/h7,10,13,18-20H,5-6,8-9,11-12,14H2,1-4H3,(H,24,25)/b15-7+,16-13+,17-10-/t18-,19-,20-/m0/s1;   InChIKey=HRPBIJBOFQXOTL-JEJSWHNFSA-N;   SMILES=[H][C@@]12CC\\C(C)=C\\CC\\C(=C\\CC\\C(C)=C\\[C@]1([H])OC(=O)[C@H]2CN(C)C)C(O)=O
 xref: PMID:10785433;   Reaxys:8589733


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  CHEBI ontology 21727
    role 21706
      biological role 21704
        antimicrobial agent 18332
          antiviral agent 10542
            anti-HIV agent 1244
              anti-HIV-1 agent 871
                17-dimethylaminolobohedleolide 0
Path 2
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  CHEBI ontology 21727
    subatomic particle 21713
      composite particle 21713
        hadron 21713
          baryon 21713
            nucleon 21713
              atomic nucleus 21713
                atom 21713
                  main group element atom 21630
                    main group molecular entity 21630
                      s-block molecular entity 21159
                        hydrogen molecular entity 21093
                          hydrides 20356
                            inorganic hydride 18047
                              pnictogen hydride 18010
                                nitrogen hydride 17827
                                  azane 17721
                                    ammonia 17720
                                      organic amino compound 17719
                                        amine 7838
                                          tertiary amine 614
                                            17-dimethylaminolobohedleolide 0
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