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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:\{[1-(7-hydroxy-2-oxo-2H-chromen-8-yl)-3-methylbut-3-en-2-yl]oxy\}sulfonic acid
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Accession:CHEBI:185279 term browser browse the term
Synonyms:exact_synonym: [1-(7-hydroxy-2-oxochromen-8-yl)-3-methylbut-3-en-2-yl] hydrogen sulate
 related_synonym: Formula=C14H14O7S;   InChI=1S/C14H14O7S/c1-8(2)12(21-22(17,18)19)7-10-11(15)5-3-9-4-6-13(16)20-14(9)10/h3-6,12,15H,1,7H2,2H3,(H,17,18,19);   InChIKey=XQLHCDLBTZLLFN-UHFFFAOYSA-N;   SMILES=S(OC(CC=1C=2OC(=O)C=CC2C=CC1O)C(C)=C)(O)(=O)=O
 xref: Chemspider:74852994;   HMDB:HMDB0132710


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  CHEBI ontology 0
    chemical entity 0
      molecular entity 0
        polyatomic entity 0
          molecule 0
            cyclic compound 0
              aromatic compound 0
                organic aromatic compound 0
                  phenylpropanoid 0
                    coumarins 0
                      hydroxycoumarin 0
                        \{[1-(7-hydroxy-2-oxo-2H-chromen-8-yl)-3-methylbut-3-en-2-yl]oxy\}sulfonic acid 0
Path 2
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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
                                  oxacycle 0
                                    benzopyran 0
                                      1-benzopyran 0
                                        chromenes 0
                                          chromenone 0
                                            coumarins 0
                                              hydroxycoumarin 0
                                                \{[1-(7-hydroxy-2-oxo-2H-chromen-8-yl)-3-methylbut-3-en-2-yl]oxy\}sulfonic acid 0
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