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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:5beta-spirostan
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Accession:CHEBI:20675 term browser browse the term
Definition:A spirostan that has formula C27H44O2.
Synonyms:related_synonym: Formula=C27H44O2;   InChI=1S/C27H44O2/c1-17-10-14-27(28-16-17)18(2)24-23(29-27)15-22-20-9-8-19-7-5-6-12-25(19,3)21(20)11-13-26(22,24)4/h17-24H,5-16H2,1-4H3/t17?,18-,19-,20+,21-,22-,23-,24-,25-,26-,27+/m0/s1;   InChIKey=INLFWQCRAJUDCR-XPCNEENDSA-N;   SMILES=[H][C@@]12CCCC[C@]1(C)[C@@]1([H])CC[C@@]3(C)[C@@]([H])(C[C@]4([H])O[C@]5(CCC(C)CO5)[C@@H](C)[C@]34[H])[C@]1([H])CC2


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 22194
    chemical entity 22193
      atom 22186
        nonmetal atom 22071
          carbon atom 21846
            organic molecular entity 21846
              lipid 18879
                steroid 14888
                  steroid fundamental parent 14672
                    spirostan 153
                      5beta-spirostan 0
                        (25R)-5beta-spirostan + 0
                        (25S)-5beta-spirostan + 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22194
    subatomic particle 22186
      composite particle 22186
        hadron 22186
          baryon 22186
            nucleon 22186
              atomic nucleus 22186
                atom 22186
                  main group element atom 22120
                    p-block element atom 22120
                      carbon group element atom 21920
                        carbon atom 21846
                          organic molecular entity 21846
                            organic molecule 21662
                              organic cyclic compound 21269
                                organic polycyclic compound 17934
                                  steroid 14888
                                    steroid fundamental parent 14672
                                      spirostan 153
                                        5beta-spirostan 0
                                          (25R)-5beta-spirostan + 0
                                          (25S)-5beta-spirostan + 0
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