CHEBI:228134 - 1,7-dodecanediol

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1,7-dodecanediol
ChEBI ID CHEBI:228134
Definition A medium-chain primary fatty alcohol that is dodecane carrying hydroxy groups at positions 1 and 7.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C12H26O2
Net Charge 0
Average Mass 202.338
Monoisotopic Mass 202.19328
InChI InChI=1S/C12H26O2/c1-2-3-6-9-12(14)10-7-4-5-8-11-13/h12-14H,2-11H2,1H3
InChIKey WFTBVPNDDYMTNW-UHFFFAOYSA-N
SMILES CCCCCC(O)CCCCCCO
ChEBI Ontology
Outgoing 1,7-dodecanediol (CHEBI:228134) is a dodecanediol (CHEBI:195615)
1,7-dodecanediol (CHEBI:228134) is a medium-chain primary fatty alcohol (CHEBI:142605)
1,7-dodecanediol (CHEBI:228134) is a secondary fatty alcohol (CHEBI:167095)
IUPAC Name
dodecane-1,7-diol
Synonym Source
1,7-dihydroxydodecane ChEBI
Manual Xref Database
CPD-17647 MetaCyc
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Last Modified
31 October 2023