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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:Azaspiracid-33
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Accession:CHEBI:145166 term browser browse the term
Synonyms:exact_synonym: (4E,8E)-10-((2S,5S)-5-((R)-hydroxy((2R,3R,5S,6S)-2-hydroxy-3,5-dimethyl-6-(3-((2S,3S,3a'R,5R,5'S,7'S,9'R,9a'R)-3,5,7'-trimethylhexahydrospiro[piperidine-2,2'-[5,9]epoxyfuro[3,2-b]oxocin]-5'(3'H)-yl)prop-1-en-2-yl)tetrahydro-2H-pyran-2-yl)methyl)tetrahydrofuran-2-yl)deca-4,8-dienoic acid
 related_synonym: AZA-33;   Formula=C41H65NO9;   InChI=1S/C41H65NO9/c1-25-19-33-37-34(23-40(50-37)29(5)18-26(2)24-42-40)49-39(21-25,48-33)22-28(4)36-27(3)20-30(6)41(46,51-36)38(45)32-17-16-31(47-32)14-12-10-8-7-9-11-13-15-35(43)44/h9-12,25-27,29-34,36-38,42,45-46H,4,7-8,13-24H2,1-3,5-6H3,(H,43,44)/b11-9+,12-10+/t25-,26+,27-,29-,30+,31+,32-,33?,34+,36-,37+,38+,39-,40-,41+/m0/s1;   InChIKey=UVQNAVZXOLGVBU-IVFQQZPMSA-N;   SMILES=[C@]1(CC[C@](O1)([C@H]([C@@]2(O[C@@]([C@H](C[C@H]2C)C)(C(=C)C[C@@]34C[C@H](C[C@@H](O3)[C@@]5([C@](O4)(C[C@]6(O5)[C@H](C[C@H](CN6)C)C)[H])[H])C)[H])O)O)[H])([H])C/C=C/CC/C=C/CCC(O)=O


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  CHEBI ontology 0
    chemical entity 0
      group 0
        polyatomic entity 0
          molecule 0
            cyclic compound 0
              polycyclic compound 0
                spiro compound 0
                  azaspiro compound 0
                    Azaspiracid-33 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
                                  organonitrogen heterocyclic compound 0
                                    azaspiro compound 0
                                      Azaspiracid-33 0
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