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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:undecan-2-one
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Accession:CHEBI:17700 term browser browse the term
Definition:A dialkyl ketone with methyl and nonyl as the two alkyl groups.
Synonyms:related_synonym: 2-Undecanone;   2-hendecanone;   Formula=C11H22O;   InChI=1S/C11H22O/c1-3-4-5-6-7-8-9-10-11(2)12/h3-10H2,1-2H3;   InChIKey=KYWIYKKSMDLRDC-UHFFFAOYSA-N;   Methyl nonyl ketone;   SMILES=CCCCCCCCCC(C)=O;   rue ketone
 alt_id: CHEBI:11658;   CHEBI:1280;   CHEBI:19792
 xref: CAS:112-12-9;   DrugBank:DB08688;   HMDB:HMDB0033713;   KEGG:C01875;   KNApSAcK:C00030758;   LIPID_MAPS_instance:LMFA12000002
 xref_mesh: MESH:C526928
 xref: MetaCyc:2-UNDECANONE;   PDBeChem:UOC;   PMID:17453350;   PMID:20931852;   PMID:21366058;   PMID:21738794;   PMID:23292923;   PPDB:1397;   Reaxys:1749573;   Wikipedia:2-Undecanone



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undecan-2-one term browser
Symbol Object Name Qualifiers Evidence Notes Source PubMed Reference(s) RGD Reference(s) Position
G Ar androgen receptor multiple interactions ISO undecan-2-one binds to and results in decreased activity of AR protein CTD PMID:27633901 NCBI chr  X:63,104,771...63,273,934
Ensembl chr  X:63,104,771...63,273,925
JBrowse link
G Esr2 estrogen receptor 2 multiple interactions ISO undecan-2-one binds to and results in decreased activity of ESR2 protein CTD PMID:27633901 NCBI chr 6:94,858,438...94,909,630
Ensembl chr 6:94,809,547...94,908,919
JBrowse link
G Nr3c1 nuclear receptor subfamily 3, group C, member 1 multiple interactions ISO undecan-2-one binds to and results in decreased activity of NR3C1 protein CTD PMID:27633901 NCBI chr18:31,271,681...31,393,320
Ensembl chr18:31,271,681...31,393,375
JBrowse link

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 20056
    role 20008
      application 19745
        pesticide 17273
          rodenticide 8005
            undecan-2-one 3
Path 2
Term Annotations click to browse term
  CHEBI ontology 20056
    subatomic particle 20054
      composite particle 20054
        hadron 20054
          baryon 20054
            nucleon 20054
              atomic nucleus 20054
                atom 20054
                  main group element atom 19956
                    p-block element atom 19956
                      carbon group element atom 19882
                        carbon atom 19875
                          organic molecular entity 19875
                            organic group 18961
                              organic divalent group 18947
                                organodiyl group 18947
                                  carbonyl group 18900
                                    carbonyl compound 18900
                                      ketone 17091
                                        dialkyl ketone 46
                                          undecan-2-one 3
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