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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:sophoraisoflavanone A
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Accession:CHEBI:27494 term browser browse the term
Definition:A hydroxyisoflavanone that is isoflavanone substituted by hydroxy groups at positions 5, 7 and 4', a methoxy substituent at position 2' and a prenyl group at position 3'.
Synonyms:exact_synonym: 5,7-dihydroxy-3-[4-hydroxy-2-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-2,3-dihydro-4H-chromen-4-one
 related_synonym: 5,7-dihydroxy-3-[4-hydroxy-2-methoxy-3-(3-methylbut-2-en-1-yl)phenyl]-2,3-dihydro-4H-1-benzopyran-4-one;   Formula=C21H22O6;   InChI=1S/C21H22O6/c1-11(2)4-5-14-16(23)7-6-13(21(14)26-3)15-10-27-18-9-12(22)8-17(24)19(18)20(15)25/h4,6-9,15,22-24H,5,10H2,1-3H3;   InChIKey=AALISTBXLBQUEH-UHFFFAOYSA-N;   SMILES=COC1=C(C=CC(O)=C1CC=C(C)C)C1COC2=C(C(O)=CC(O)=C2)C1=O
 alt_id: CHEBI:26722;   CHEBI:9197
 xref: CAS:69573-59-7;   KEGG:C10530;   KNApSAcK:C00002573;   LIPID_MAPS_instance:LMPK12050480;   PMID:11705451;   PMID:15636183;   PMID:17658714;   PMID:19557362;   PMID:31619703;   Reaxys:1667139



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Term Annotations click to browse term
  CHEBI ontology 19808
    role 19784
      biological role 19782
        antimicrobial agent 18141
          sophoraisoflavanone A 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19808
    subatomic particle 19806
      composite particle 19806
        hadron 19806
          baryon 19806
            nucleon 19806
              atomic nucleus 19806
                atom 19806
                  main group element atom 19756
                    p-block element atom 19756
                      carbon group element atom 19705
                        carbon atom 19702
                          organic molecular entity 19702
                            organic molecule 19655
                              organic cyclic compound 19468
                                organic heterocyclic compound 18848
                                  oxacycle 17866
                                    benzopyran 11952
                                      1-benzopyran 11704
                                        isoflavonoid 3821
                                          isoflavans 136
                                            isoflavanones 86
                                              hydroxyisoflavanone 5
                                                sophoraisoflavanone A 0
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