EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:176576 - 1,9-decanediol

ChEBI IDCHEBI:176576
ChEBI Name1,9-decanediol
Stars
DefinitionA diol that is decane substituted by hydroxy groups at position 1 and 9. It is a natural product found in rice root exudates and acts as an effective biological nitrification inhibitor for soil ammonia-oxidizing bacteria and archaea.
Last Modified23 June 2021
DownloadsMolfile
FormulaC10H22O2
Net Charge0
Average Mass174.284
Monoisotopic Mass174.16198
SMILESCC(O)CCCCCCCCO
InChIInChI=1S/C10H22O2/c1-10(12)8-6-4-2-3-5-7-9-11/h10-12H,2-9H2,1H3
InChIKeyBRBMYNGGGPTKKL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Oryza sativa (ncbitaxon:4530) - PubMed (27292630) Identified in root exudates. Strain: WYJ7
Roles Classification
Biological Roles:
nitrification inhibitor  Any inhibitor added to nitrogen fertilizers which can reduce the rate at which ammonium is converted to nitrate. Under appropriate conditions, this can help reduce nitrogen losses through denitrification and leaching.
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
ChEBI Ontology
Outgoing Relation(s)
1,9-decanediol (CHEBI:176576) has role nitrification inhibitor (CHEBI:148436)
1,9-decanediol (CHEBI:176576) has role plant metabolite (CHEBI:76924)
1,9-decanediol (CHEBI:176576) is a aliphatic alcohol (CHEBI:2571)
1,9-decanediol (CHEBI:176576) is a diol (CHEBI:23824)
1,9-decanediol (CHEBI:176576) is a primary alcohol (CHEBI:15734)
1,9-decanediol (CHEBI:176576) is a secondary alcohol (CHEBI:35681)
IUPAC Name 
decane-1,9-diol
Manual XrefsDatabases
9085333ChemSpider
Registry NumbersSources
CAS:3208-05-7ChEBI
Citations