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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:1-oxo-3beta,23-dihydroxyolean-12-en-28-oic acid
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Accession:CHEBI:67946 term browser browse the term
Definition:A natural product found in Juglans sinensis.
Synonyms:exact_synonym: 3beta,23-dihydroxy-1-oxoolean-12-en-28-oic acid
 related_synonym: Formula=C30H46O5;   InChI=1S/C30H46O5/c1-25(2)11-13-30(24(34)35)14-12-27(4)18(19(30)16-25)7-8-21-28(27,5)10-9-20-26(3,17-31)22(32)15-23(33)29(20,21)6/h7,19-22,31-32H,8-17H2,1-6H3,(H,34,35)/t19-,20-,21-,22-,26-,27+,28+,29-,30-/m0/s1;   InChIKey=BYWZDPHXZQSASO-DLRRJOOFSA-N;   SMILES=CC1(C)CC[C@@]2(CC[C@]3(C)C(=CC[C@H]4[C@@]3(C)CC[C@H]3[C@](C)(CO)[C@@H](O)CC(=O)[C@]43C)[C@@H]2C1)C(O)=O
 xref: PMID:21309591;   Reaxys:9459129

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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            eukaryotic metabolite 0
              plant metabolite 0
                1-oxo-3beta,23-dihydroxyolean-12-en-28-oic acid 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
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      hydroxy carboxylic acid 0
                                        hydroxy monocarboxylic acid 0
                                          dihydroxy monocarboxylic acid 0
                                            1-oxo-3beta,23-dihydroxyolean-12-en-28-oic acid 0
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