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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 19909
    role 19880
      application 19720
        indicator 8784
          biomarker 6596
            brassicasterol 0
              brassicasterol 3-beta-D-glucoside 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19909
    subatomic particle 19907
      composite particle 19907
        hadron 19907
          baryon 19907
            nucleon 19907
              atomic nucleus 19907
                atom 19907
                  main group element atom 19846
                    p-block element atom 19846
                      carbon group element atom 19784
                        carbon atom 19781
                          organic molecular entity 19781
                            organic molecule 19735
                              organic cyclic compound 19528
                                organic polycyclic compound 17344
                                  steroid 15164
                                    hydroxy steroid 14987
                                      3-hydroxy steroid 13668
                                        3beta-hydroxy steroid 2552
                                          3beta-hydroxy-Delta(5)-steroid 2377
                                            brassicasterol 0
                                              brassicasterol 3-beta-D-glucoside 0
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