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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:alexidine
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Accession:CHEBI:53661 term browser browse the term
Definition:An amphipathic bisbiguanide with a structure consisting of two (2-ethylhexyl)guanide units linked by a hexamethylene bridge.
Synonyms:exact_synonym: N,N''''-hexane-1,6-diylbis[N'-(2-ethylhexyl)(imidodicarbonimidic diamide)]
 related_synonym: 1,1'-Hexamethylenebis(5-(2-ethylhexyl)biguanide);   Formula=C26H56N10;   InChI=1S/C26H56N10/c1-5-9-15-21(7-3)19-33-25(29)35-23(27)31-17-13-11-12-14-18-32-24(28)36-26(30)34-20-22(8-4)16-10-6-2/h21-22H,5-20H2,1-4H3,(H5,27,29,31,33,35)(H5,28,30,32,34,36);   InChIKey=LFVVNPBBFUSSHL-UHFFFAOYSA-N;   N,N'-bis(2-ethylhexyl)-3,12-diimino-2,4,11,13-tetraazatetradecanediimidamide;   SMILES=CCCCC(CC)CNC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NCC(CC)CCCC;   alexidina;   alexidinum;   bisguadine
 xref: Beilstein:2404807;   CAS:22573-93-9;   Drug_Central:113;   LINCS:LSM-4432
 xref_mesh: MESH:C001570
 xref: PMID:10848923;   PMID:22152633;   PMID:22495680;   PMID:23492900;   PMID:23970139;   PMID:24139264;   PMID:265389;   PMID:381628;   Patent:CN101624356;   Reaxys:2404807;   Wikipedia:Alexidine

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Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        antimicrobial agent 0
          antibacterial agent 0
            alexidine 0
Path 2
Term Annotations click to browse term
  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
                            heteroorganic entity 0
                              organonitrogen compound 0
                                guanidines 0
                                  biguanides 0
                                    alexidine 0
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