CHEBI:87184 - hexamidine

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ChEBI Name hexamidine
ChEBI ID CHEBI:87184
Definition A polyether that is the bis(4-guanidinophenyl) ether of hexane-1,6-diol.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Kevin
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Formula C20H26N4O2
Net Charge 0
Average Mass 354.44600
Monoisotopic Mass 354.20558
InChI InChI=1S/C20H26N4O2/c21-19(22)15-5-9-17(10-6-15)25-13-3-1-2-4-14-26-18-11-7-16(8-12-18)20(23)24/h5-12H,1-4,13-14H2,(H3,21,22)(H3,23,24)
InChIKey OQLKNTOKMBVBKV-UHFFFAOYSA-N
SMILES NC(=N)c1ccc(OCCCCCCOc2ccc(cc2)C(N)=N)cc1
Roles Classification
Biological Role(s): antimicrobial agent
A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
Application(s): antiseptic drug
A substance used locally on humans and other animals to destroy harmful microorganisms or to inhibit their activity (cf. disinfectants, which destroy microorganisms found on non-living objects, and antibiotics, which can be transported through the lymphatic system to destroy bacteria within the body).
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ChEBI Ontology
Outgoing hexamidine (CHEBI:87184) has functional parent hexane-1,6-diol (CHEBI:43078)
hexamidine (CHEBI:87184) has role antimicrobial agent (CHEBI:33281)
hexamidine (CHEBI:87184) has role antiseptic drug (CHEBI:48218)
hexamidine (CHEBI:87184) is a aromatic ether (CHEBI:35618)
hexamidine (CHEBI:87184) is a guanidines (CHEBI:24436)
hexamidine (CHEBI:87184) is a polyether (CHEBI:46774)
IUPAC Name
4,4'-[hexane-1,6-diylbis(oxy)]di(benzene-1-carboximidamide)
INNs Sources
hexamidina ChemIDplus
hexamidine ChemIDplus
hexamidine ChemIDplus
hexamidinum ChemIDplus
Synonyms Sources
4,4'-(1,6-Hexanediylbis(oxy))bis-benzenecarboximidamide ChemIDplus
4,4'-(Hexamethylenedioxy)dibenzamidine ChemIDplus
Manual Xrefs Databases
3275 DrugCentral
D07206 KEGG DRUG
DB03808 DrugBank
DID PDBeChem
EP93186 Patent
GB507565 Patent
Hexamidine Wikipedia
View more database links
Registry Numbers Types Sources
2599985 Reaxys Registry Number Reaxys
3811-75-4 CAS Registry Number KEGG DRUG
Citations Waiting for Citations Types Sources
25169145 PubMed citation Europe PMC
25779009 PubMed citation Europe PMC
26235920 PubMed citation Europe PMC
Last Modified
22 February 2017