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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 397
    role 397
      biological role 397
        prohormone 0
          ecdysone 0
            2,22,25-trideoxyecdysone 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 397
    subatomic particle 397
      composite particle 397
        hadron 397
          baryon 397
            nucleon 397
              atomic nucleus 397
                atom 397
                  main group element atom 390
                    p-block element atom 390
                      carbon group element atom 379
                        carbon atom 378
                          organic molecular entity 378
                            organic molecule 368
                              organic cyclic compound 352
                                organic polycyclic compound 66
                                  steroid 40
                                    hydroxy steroid 20
                                      3-hydroxy steroid 7
                                        sterol 2
                                          3beta-sterol 2
                                            ecdysone 0
                                              2,22,25-trideoxyecdysone 0
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