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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:(-)-bursehernin
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Accession:CHEBI:90893 term browser browse the term
Definition:A butan-4-olide that is (-)-pluviatolide in which the phenolic hydroxy group has been converted to the corresponding methyl ether.
Synonyms:exact_synonym: (3R,4R)-4-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dimethoxybenzyl)dihydrofuran-2(3H)-one
 related_synonym: (-)-5'-desmethoxy-yatein;   (3R-trans)-4-(1,3-benzodioxol-5-ylmethyl)-3-[(3,4-dimethoxyphenyl)methyl]dihydro-2(3H)-furanone;   (R,R)-4-(1,3-benzodioxol-5-ylmethyl)-3-(3,4-dimethoxybenzyl)dihydrofuran-2(3H)-one;   Formula=C21H22O6;   InChI=1S/C21H22O6/c1-23-17-5-3-14(9-19(17)24-2)8-16-15(11-25-21(16)22)7-13-4-6-18-20(10-13)27-12-26-18/h3-6,9-10,15-16H,7-8,11-12H2,1-2H3/t15-,16+/m0/s1;   InChIKey=IYBDDRJHJMFFBB-JKSUJKDBSA-N;   SMILES=C([C@@H]1[C@H](COC1=O)CC2=CC=C3OCOC3=C2)C4=CC=C(OC)C(=C4)OC
 xref: CAS:40456-51-7;   CBA:464313;   KNApSAcK:C00036847
 xref_mesh: MESH:C023816
 xref: MetaCyc:CPD-17599;   PMID:10230514;   PMID:14987061;   PMID:18680297;   PMID:19329133;   PMID:24242108;   PMID:26130043;   PMID:26359402;   PMID:7843329;   Reaxys:3596448



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(-)-bursehernin term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Esr1 estrogen receptor 1 affects binding ISO bursehernin binds to ESR1 protein CTD PMID:35631411 NCBI chr 1:41,106,335...41,499,104
Ensembl chr 1:41,210,475...41,495,002
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  CHEBI ontology 19834
    role 19810
      biological role 19808
        biochemical role 19517
          metabolite 19504
            eukaryotic metabolite 19322
              plant metabolite 17944
                (-)-bursehernin 1
                  (-)-5'-desmethylyatein 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19834
    subatomic particle 19832
      composite particle 19832
        hadron 19832
          baryon 19832
            nucleon 19832
              atomic nucleus 19832
                atom 19832
                  main group element atom 19782
                    p-block element atom 19782
                      carbon group element atom 19730
                        carbon atom 19727
                          organic molecular entity 19727
                            organic group 18947
                              organic divalent group 18922
                                organodiyl group 18922
                                  carbonyl group 18879
                                    carbonyl compound 18879
                                      carboxylic ester 16481
                                        lactone 12523
                                          gamma-lactone 6858
                                            butan-4-olide 309
                                              (-)-pluviatolide 1
                                                (-)-bursehernin 1
                                                  (-)-5'-desmethylyatein 0
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