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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:2,22,25-trideoxyecdysone
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Accession:CHEBI:19290 term browser browse the term
Definition:A 3beta-hydroxy steroid that is 5beta-cholestane containing a double bond between positions 7 and 8, and substituted by an oxo group at position 6 and by hydroxy groups at the 3beta and 14alpha positions.
Synonyms:exact_synonym: 3beta,14-dihydroxy-5beta-cholest-7-en-6-one
 related_synonym: 3beta,14alpha-Dihydroxy-5beta-cholest-7-en-6-one;   Formula=C27H44O3;   InChI=1S/C27H44O3/c1-17(2)7-6-8-18(3)20-11-14-27(30)22-16-24(29)23-15-19(28)9-12-25(23,4)21(22)10-13-26(20,27)5/h16-21,23,28,30H,6-15H2,1-5H3/t18-,19+,20-,21+,23+,25-,26-,27-/m1/s1;   InChIKey=FADCOUQPHXGWQS-ZCDXYYCTSA-N;   SMILES=[H][C@@]1(CC[C@@]2(O)C3=CC(=O)[C@]4([H])C[C@@H](O)CC[C@]4(C)[C@@]3([H])CC[C@]12C)[C@H](C)CCCC(C)C
 xref: CAS:39219-57-3;   KEGG:C16493;   Reaxys:5304720


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Path 1
Term Annotations click to browse term
  CHEBI ontology 909
    role 868
      biological role 868
        prohormone 0
          ecdysone 0
            2,22,25-trideoxyecdysone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 909
    subatomic particle 894
      composite particle 894
        hadron 894
          baryon 894
            nucleon 894
              atomic nucleus 894
                atom 894
                  main group element atom 863
                    p-block element atom 860
                      carbon group element atom 836
                        carbon atom 835
                          organic molecular entity 835
                            organic molecule 750
                              organic cyclic compound 659
                                organic polycyclic compound 134
                                  steroid 97
                                    hydroxy steroid 65
                                      3-hydroxy steroid 41
                                        sterol 6
                                          3beta-sterol 6
                                            ecdysone 0
                                              2,22,25-trideoxyecdysone 0
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