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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:globostellatic acid C
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Accession:CHEBI:72308 term browser browse the term
Definition:A tricyclic triterpenoid of the isomalabaricane group.
Synonyms:exact_synonym: (3Z,3aS,5aR,6R,7R,9aR,9bS)-7-(acetyloxy)-3-[(3E,5E,7E)-10-hydroxy-9-methoxy-6,10-dimethylundeca-3,5,7-trien-2-ylidene]-3a,6,9a-trimethyl-2-oxododecahydro-1H-cyclopenta[a]naphthalene-6-carboxylic acid
 related_synonym: Formula=C33H48O7;   InChI=1S/C33H48O7/c1-20(13-14-26(39-9)30(4,5)38)11-10-12-21(2)28-23(35)19-25-31(6)18-16-27(40-22(3)34)33(8,29(36)37)24(31)15-17-32(25,28)7/h10-14,24-27,38H,15-19H2,1-9H3,(H,36,37)/b12-10+,14-13+,20-11+,28-21+/t24-,25+,26?,27-,31+,32+,33-/m1/s1;   InChIKey=DIBFODPMNNITET-MYCFXNEXSA-N;   SMILES=[H][C@@]12CC[C@@]3(C)[C@@]([H])(CC(=O)\\C3=C(C)/C=C/C=C(C)/C=C/C(OC)C(C)(C)O)[C@@]1(C)CC[C@@H](OC(C)=O)[C@]2(C)C(O)=O
 cyclic_relationship: is_conjugate_acid_of CHEBI:72306


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Path 1
Term Annotations click to browse term
  CHEBI ontology 5081
    role 5046
      biological role 5046
        biochemical role 4966
          metabolite 4954
            globostellatic acid C 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 5081
    subatomic particle 5072
      composite particle 5072
        hadron 5072
          baryon 5072
            nucleon 5072
              atomic nucleus 5072
                atom 5072
                  main group element atom 5042
                    p-block element atom 5039
                      carbon group element atom 4957
                        carbon atom 4956
                          organic molecular entity 4956
                            heteroorganic entity 4796
                              organochalcogen compound 4758
                                organooxygen compound 4719
                                  carbon oxoacid 375
                                    carboxylic acid 370
                                      monocarboxylic acid 208
                                        acetic acid 55
                                          acetate ester 25
                                            globostellatic acid C 0
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