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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:5-(3-hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran
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Accession:CHEBI:69245 term browser browse the term
Definition:A member of the class of benzofurans that is 1-benzofuran substituted by a 3-hydroxypropyl group at position 5 and a 4-hydroxy-2-methoxyphenyl group at position 2. It is a lignan derivative isolated from the roots of Krameria lappacea.
Synonyms:exact_synonym: 4-[5-(3-hydroxypropyl)-1-benzofuran-2-yl]-3-methoxyphenol
 related_synonym: Formula=C18H18O4;   InChI=1S/C18H18O4/c1-21-17-11-14(20)5-6-15(17)18-10-13-9-12(3-2-8-19)4-7-16(13)22-18/h4-7,9-11,19-20H,2-3,8H2,1H3;   InChIKey=CLYYUOMSXIPPJS-UHFFFAOYSA-N;   SMILES=COc1cc(O)ccc1-c1cc2cc(CCCO)ccc2o1
 xref: PMID:21800856;   Reaxys:6423532

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        anti-inflammatory agent 0
          5-(3-hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran 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
                                carbocyclic compound 0
                                  benzenoid aromatic compound 0
                                    benzenes 0
                                      methoxybenzenes 0
                                        monomethoxybenzene 0
                                          5-(3-hydroxypropyl)-2-(2-methoxy-4-hydroxyphenyl)benzofuran 0
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