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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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Term Annotations click to browse term
  CHEBI ontology 19932
    role 19904
      application 19741
        indicator 8783
          biomarker 6585
            brassicasterol 0
              brassicasterol 3-beta-D-glucoside 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19932
    subatomic particle 19930
      composite particle 19930
        hadron 19930
          baryon 19930
            nucleon 19930
              atomic nucleus 19930
                atom 19930
                  main group element atom 19876
                    p-block element atom 19876
                      carbon group element atom 19816
                        carbon atom 19812
                          organic molecular entity 19812
                            organic molecule 19764
                              organic cyclic compound 19553
                                organic polycyclic compound 17274
                                  steroid 14723
                                    hydroxy steroid 14470
                                      3-hydroxy steroid 12813
                                        3beta-hydroxy steroid 2544
                                          3beta-hydroxy-Delta(5)-steroid 2370
                                            brassicasterol 0
                                              brassicasterol 3-beta-D-glucoside 0
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