CHEBI:228137 - 1,12-dodecanediol

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ChEBI Name 1,12-dodecanediol ChEBI ID CHEBI:228137 Definition A medium-chain primary fatty alcohol that is dodecane carrying hydroxy groups at positions 1 and 12. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H26O2 Net Charge 0 Average Mass 202.338 Monoisotopic Mass 202.19328 InChI InChI=1S/C12H26O2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h13-14H,1-12H2 InChIKey GHLKSLMMWAKNBM-UHFFFAOYSA-N SMILES OCCCCCCCCCCCCO Metabolite of Species Details Escherichia coli (NCBI:txid562) See: PubMed Roles Classification Biological Role(s): Escherichia coli metabolite Any bacterial metabolite produced during a metabolic reaction in Escherichia coli. View more via ChEBI Ontology ChEBI Ontology Outgoing 1,12-dodecanediol (CHEBI:228137) has role Escherichia coli metabolite (CHEBI:76971) 1,12-dodecanediol (CHEBI:228137) is a dodecanediol (CHEBI:195615) 1,12-dodecanediol (CHEBI:228137) is a medium-chain primary fatty alcohol (CHEBI:142605) IUPAC Name dodecane-1,12-diol Synonyms Sources 1,12-dihydroxydodecane ChEBI dodecamethylene glycol ChEBI Registry Numbers Types Sources 1742760 Reaxys Registry Number Reaxys 5675-51-4 CAS Registry Number NIST Chemistry WebBook Citations Types Sources 12668098 PubMed citation Europe PMC 29180361 PubMed citation Europe PMC 32257747 PubMed citation Europe PMC 32315527 PubMed citation Europe PMC 36321630 PubMed citation Europe PMC 36549626 PubMed citation Europe PMC 37335183 PubMed citation Europe PMC 37597594 PubMed citation Europe PMC Last Modified 31 October 2023