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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:Fistularin-3
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Accession:CHEBI:206609 term browser browse the term
Synonyms:exact_synonym: (5S,6R)-7,9-dibromo-N-[3-[2,6-dibromo-4-[2-[[(5S,6R)-7,9-dibromo-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carbonyl]amino]-1-hydroxyethyl]phenoxy]-2-hydroxypropyl]-6-hydroxy-8-methoxy-1-oxa-2-azaspiro[4.5]deca-2,7,9-triene-3-carboxamide
 related_synonym: Formula=C31H30Br6N4O11;   InChI=1S/C31H30Br6N4O11/c1-48-24-16(34)5-30(26(44)21(24)36)7-18(40-51-30)28(46)38-9-13(42)11-50-23-14(32)3-12(4-15(23)33)20(43)10-39-29(47)19-8-31(52-41-19)6-17(35)25(49-2)22(37)27(31)45/h3-6,13,20,26-27,42-45H,7-11H2,1-2H3,(H,38,46)(H,39,47)/t13?,20?,26-,27-,30+,31+/m0/s1;   InChIKey=TURTULDFIIAPTC-CJQKJACMSA-N;   SMILES=BrC=1C(OC)=C(Br)[C@H](O)[C@]2(C1)ON=C(C2)C(=O)NCC(O)C3=CC(Br)=C(OCC(O)CNC(=O)C4=NO[C@@]5(C4)C=C(Br)C(OC)=C([C@@H]5O)Br)C(=C3)Br
 xref: Chemspider:139890

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Term Annotations click to browse term
  CHEBI ontology 2
    chemical entity 2
      group 2
        polyatomic entity 2
          molecule 2
            organic molecule 2
              organic cyclic compound 2
                organic aromatic compound 1
                  aromatic ether 0
                    Fistularin-3 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 2
    subatomic particle 2
      composite particle 2
        hadron 2
          baryon 2
            nucleon 2
              atomic nucleus 2
                atom 2
                  main group element atom 2
                    main group molecular entity 2
                      p-block molecular entity 2
                        carbon group molecular entity 2
                          organic molecular entity 2
                            heteroorganic entity 2
                              organochalcogen compound 1
                                organooxygen compound 0
                                  ether 0
                                    aromatic ether 0
                                      Fistularin-3 0
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