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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:13-desmethylspirolide C
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Accession:CHEBI:145170 term browser browse the term
Synonyms:related_synonym: Formula=C42H61NO7;   InChI=1S/C42H61NO7/c1-25-9-8-10-37-40(23-28(4)29(5)24-43-37)15-13-33(36-21-27(3)38(45)47-36)30(6)34(40)20-26(2)35(44)22-32-12-16-41(48-32)17-18-42(50-41)39(7,46)14-11-31(19-25)49-42/h20-21,28-29,31-32,34-36,44,46H,1,8-19,22-24H2,2-7H3/b26-20+/t28-,29-,31-,32-,34?,35-,36?,39+,40+,41+,42+/m0/s1;   InChIKey=TWYUDVVIPSUDIG-MTEFJGGFSA-N;   SMILES=C1(C(=CC(O1)C2=C(C3[C@]4(CC2)C(=NC[C@@H]([C@H](C4)C)C)CCCC(C[C@H]5O[C@]6([C@@](CC5)(O)C)CC[C@@]7(O6)O[C@@H](CC7)C[C@@H](C(=C3)C)O)=C)C)C)=O
 xref_mesh: MESH:C517170



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13-desmethylspirolide C term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Chrna4 cholinergic receptor nicotinic alpha 4 subunit multiple interactions ISO 13-desmethylspirolide C binds to and results in decreased activity of [CHRNA4 protein binds to CHRNB2 protein] CTD PMID:26063663 NCBI chr 3:168,136,246...168,157,839
Ensembl chr 3:168,136,266...168,156,957
JBrowse link
G Chrna7 cholinergic receptor nicotinic alpha 7 subunit multiple interactions ISO 13-desmethylspirolide C binds to and results in decreased activity of CHRNA7 protein CTD PMID:26063663 NCBI chr 1:116,715,286...116,837,223
Ensembl chr 1:116,714,711...116,837,240
JBrowse link
G Chrnb2 cholinergic receptor nicotinic beta 2 subunit multiple interactions ISO 13-desmethylspirolide C binds to and results in decreased activity of [CHRNA4 protein binds to CHRNB2 protein] CTD PMID:26063663 NCBI chr 2:175,181,402...175,189,619
Ensembl chr 2:175,181,402...175,189,619
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19659
    chemical entity 19658
      group 19661
        polyatomic entity 19617
          molecule 19525
            cyclic compound 19383
              polycyclic compound 18749
                spiro compound 4935
                  azaspiro compound 815
                    13-desmethylspirolide C 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 19659
    subatomic particle 19658
      composite particle 19658
        hadron 19658
          baryon 19658
            nucleon 19658
              atomic nucleus 19700
                atom 19658
                  main group element atom 19607
                    p-block element atom 19607
                      carbon group element atom 19550
                        carbon atom 19547
                          organic molecular entity 19588
                            organic molecule 19506
                              organic cyclic compound 19324
                                organic heterocyclic compound 18682
                                  organonitrogen heterocyclic compound 17878
                                    azaspiro compound 815
                                      13-desmethylspirolide C 3
paths to the root