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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:Allochenodeoxycholate
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Accession:CHEBI:81258 term browser browse the term
Definition:A cholanoid that has formula C24H40O4.
Synonyms:related_synonym: 3alpha,7alpha-Dihydroxy-5alpha-cholanoic acid;   Allochenodeoxycholic acid;   Formula=C24H40O4;   InChI=1S/C24H40O4/c1-14(4-7-21(27)28)17-5-6-18-22-19(9-11-24(17,18)3)23(2)10-8-16(25)12-15(23)13-20(22)26/h14-20,22,25-26H,4-13H2,1-3H3,(H,27,28)/t14-,15-,16-,17-,18+,19+,20-,22+,23+,24-/m1/s1;   InChIKey=RUDATBOHQWOJDD-IKAPKQLESA-N;   SMILES=C[C@H](CCC(O)=O)[C@H]1CC[C@H]2[C@@H]3[C@H](O)C[C@H]4C[C@H](O)CC[C@]4(C)[C@H]3CC[C@]12C
 xref: KEGG:C17664


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22192
    chemical entity 22191
      atom 22184
        nonmetal atom 22069
          carbon atom 21844
            organic molecular entity 21844
              lipid 18878
                steroid 14888
                  cholanoid 1013
                    Allochenodeoxycholate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22192
    subatomic particle 22184
      composite particle 22184
        hadron 22184
          baryon 22184
            nucleon 22184
              atomic nucleus 22184
                atom 22184
                  main group element atom 22118
                    p-block element atom 22118
                      carbon group element atom 21918
                        carbon atom 21844
                          organic molecular entity 21844
                            organic molecule 21660
                              organic cyclic compound 21266
                                organic polycyclic compound 17935
                                  steroid 14888
                                    steroid fundamental parent 14672
                                      cholane 1013
                                        cholanoid 1013
                                          Allochenodeoxycholate 0
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