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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 21737
    role 21715
      biological role 21713
        prohormone 6
          ecdysone 6
            2,22,25-trideoxyecdysone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 21737
    subatomic particle 21723
      composite particle 21723
        hadron 21723
          baryon 21723
            nucleon 21723
              atomic nucleus 21723
                atom 21723
                  main group element atom 21638
                    p-block element atom 21638
                      carbon group element atom 21444
                        carbon atom 21345
                          organic molecular entity 21345
                            organic molecule 21240
                              organic cyclic compound 20831
                                organic polycyclic compound 17284
                                  steroid 13239
                                    hydroxy steroid 12820
                                      3-hydroxy steroid 10505
                                        sterol 454
                                          3beta-sterol 448
                                            ecdysone 6
                                              2,22,25-trideoxyecdysone 0
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