Send us a Message



Submit Data |  Help |  Video Tutorials |  News |  Publications |  Download |  REST API |  Citing RGD |  Contact   

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:dodeclonium
go back to main search page
Accession:CHEBI:166833 term browser browse the term
Definition:An aromatic ether that is 4-chlorophenol in which the hydroxy group is replaced by a 2-[dodecyl(dimethyl)azaniumyl]ethoxy group.
Synonyms:exact_synonym: N-[2-(4-chlorophenoxy)ethyl]-N,N-dimethyldodecan-1-aminium
 related_synonym: Formula=C22H39ClNO;   InChI=1S/C22H39ClNO/c1-4-5-6-7-8-9-10-11-12-13-18-24(2,3)19-20-25-22-16-14-21(23)15-17-22/h14-17H,4-13,18-20H2,1-3H3/q+1;   InChIKey=DIQMZVPLKDZWFT-UHFFFAOYSA-N;   N-(2-(4-chlorophenoxy)ethyl)-N,N-dimethyl-1-dodecanaminium;   SMILES=CCCCCCCCCCCC[N+](C)(C)CCOC1=CC=C(Cl)C=C1;   dodeclonium cation;   dodeclonium ion
 xref: CAS:123247-90-5


show annotations for term's descendants           Sort by:
 

Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19781
    chemical entity 19781
      molecular entity 19779
        ion 15942
          organic ion 8462
            organic cation 7320
              quaternary ammonium ion 5109
                dodeclonium 0
                  dodeclonium bromide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19781
    subatomic particle 19779
      composite particle 19779
        hadron 19779
          baryon 19779
            nucleon 19779
              atomic nucleus 19779
                atom 19779
                  main group element atom 19669
                    p-block element atom 19669
                      carbon group element atom 19588
                        carbon atom 19578
                          organic molecular entity 19578
                            organic molecule 19510
                              organic cyclic compound 19337
                                carbocyclic compound 18300
                                  benzenoid aromatic compound 17411
                                    benzenes 17183
                                      chlorobenzenes 13592
                                        monochlorobenzenes 9717
                                          dodeclonium 0
                                            dodeclonium bromide 0
paths to the root