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ONTOLOGY REPORT - ANNOTATIONS


Term:(6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan
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Accession:CHEBI:50118 term browser browse the term
Definition:A member of the class of pterocarpans that is (6aS,11aS)-3,6a,9-trihydroxypterocarpan in which the hydrogen atom at position 2 is substituted by a 3-methylbut-2-en-1-yl group.
Synonyms:exact_synonym: (6aS,11aS)-2-(3-methylbut-2-en-1-yl)-6H-[1]benzofuro[3,2-c]chromene-3,6a,9(11aH)-triol
 related_synonym: (+)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan;   2-dimethylallylglycinol;   Formula=C20H20O5;   Glyceocarpin;   InChI=1S/C20H20O5/c1-11(2)3-4-12-7-14-17(9-16(12)22)24-10-20(23)15-6-5-13(21)8-18(15)25-19(14)20/h3,5-9,19,21-23H,4,10H2,1-2H3/t19-,20+/m0/s1;   InChIKey=TUXXPRXOVFCNPC-VQTJNVASSA-N;   SMILES=[H][C@@]12Oc3cc(O)ccc3[C@]1(O)COc1cc(O)c(CC=C(C)C)cc21;   pterocarpan glyceocarpin
 xref: CAS:77979-22-7 "KEGG COMPOUND";   KEGG:C15509;   KNApSAcK:C00009688;   MetaCyc:CPD-4404;   PMID:10956166 "Europe PMC";   Reaxys:7388960 "Reaxys"


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  CHEBI ontology 0
    role 0
      biological role 0
        antimicrobial agent 0
          3,6,9-trihydroxypterocarpan 0
            (6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                organic heterocyclic compound 0
                                  organic heteropolycyclic compound 0
                                    benzofurochromene 0
                                      pterocarpans 0
                                        3,6,9-trihydroxypterocarpan 0
                                          (6aS,11aS)-2-dimethylallyl-3,6a,9-trihydroxypterocarpan 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.