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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:N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-[(phenylmethyl)sulfonylamino]ethyl]-3-oxanyl]-1,3-benzodioxole-5-carboxamide
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Accession:CHEBI:122385 term browser browse the term
Definition:A C-glycosyl compound that has formula C23H28N2O7S.
Synonyms:related_synonym: Formula=C23H28N2O7S;   InChI=1S/C23H28N2O7S/c26-13-22-19(25-23(27)17-6-9-20-21(12-17)31-15-30-20)8-7-18(32-22)10-11-24-33(28,29)14-16-4-2-1-3-5-16/h1-6,9,12,18-19,22,24,26H,7-8,10-11,13-15H2,(H,25,27)/t18-,19+,22-/m1/s1;   InChIKey=PWRMKQUARCEQEU-XQBPLPMBSA-N;   SMILES=C1C[C@@H]([C@H](O[C@H]1CCNS(=O)(=O)CC2=CC=CC=C2)CO)NC(=O)C3=CC4=C(C=C3)OCO4
 xref: LINCS:LSM-33828


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  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          oxygen atom 0
            oxygen molecular entity 0
              organooxygen compound 0
                carbohydrates and carbohydrate derivatives 0
                  carbohydrate derivative 0
                    C-glycosyl compound 0
                      N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-[(phenylmethyl)sulfonylamino]ethyl]-3-oxanyl]-1,3-benzodioxole-5-carboxamide 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
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbohydrates and carbohydrate derivatives 0
                                    carbohydrate 0
                                      carbohydrate derivative 0
                                        glycosyl compound 0
                                          C-glycosyl compound 0
                                            N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-[(phenylmethyl)sulfonylamino]ethyl]-3-oxanyl]-1,3-benzodioxole-5-carboxamide 0
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