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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:brassicasterol
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Accession:CHEBI:3168 term browser browse the term
Definition:An 3beta-sterol that is (22E)-ergosta-5,22-diene substituted by a hydroxy group at position 3beta. It is a phytosterol found in marine algae, fish, and rapeseed oil.
Synonyms:exact_synonym: (22E)-ergosta-5,22-dien-3beta-ol
 related_synonym: (22E,24R)-24-methylcholesta-5,22-dien-3beta-ol;   (3beta,22E)-ergosta-5,22-dien-3-ol;   24(R)-Methylcholesta-5,22E-dien-3beta-ol;   24-methyl cholest-5,22-dien-3beta-ol;   Brassicasterin;   Ergosta-5,22(E)-dien-3beta-ol;   Formula=C28H46O;   InChI=1S/C28H46O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h7-9,18-20,22-26,29H,10-17H2,1-6H3/b8-7+/t19-,20+,22-,23-,24+,25-,26-,27-,28+/m0/s1;   InChIKey=OILXMJHPFNGGTO-ZAUYPBDWSA-N;   SMILES=[C@@]12([C@]3([C@@]([C@@]4(C(C[C@@H](O)CC4)=CC3)C)(CC[C@@]1([C@@]([C@@H](/C=C/[C@@H](C(C)C)C)C)(CC2)[H])C)[H])[H])[H];   ergosta-5,22E-dien-3beta-ol
 xref: CAS:474-67-9;   FooDB:FDB012496;   HMDB:HMDB0011181;   KEGG:C08813;   KNApSAcK:C00003646;   LIPID_MAPS_instance:LMST01030098;   MetaCyc:CPD-4161;   PMID:11319028;   PMID:12162789;   PMID:15489546;   PMID:21585343;   PMID:29397797;   PMID:30259993;   PMID:30390455;   PMID:30853340;   PMID:30857717;   PMID:31255261;   PMID:31374906;   Wikipedia:Brassicasterol


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Path 1
Term Annotations click to browse term
  CHEBI ontology 20871
    role 20829
      application 20632
        indicator 8820
          biomarker 6604
            brassicasterol 0
              brassicasterol 3-beta-D-glucoside 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20871
    subatomic particle 20869
      composite particle 20869
        hadron 20869
          baryon 20869
            nucleon 20869
              atomic nucleus 20869
                atom 20869
                  main group element atom 20792
                    p-block element atom 20792
                      carbon group element atom 20725
                        carbon atom 20721
                          organic molecular entity 20721
                            organic molecule 20665
                              organic cyclic compound 20414
                                organic polycyclic compound 17557
                                  steroid 15307
                                    hydroxy steroid 15126
                                      3-hydroxy steroid 13794
                                        3beta-hydroxy steroid 2587
                                          3beta-hydroxy-Delta(5)-steroid 2413
                                            brassicasterol 0
                                              brassicasterol 3-beta-D-glucoside 0
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