CHEBI:78304 - nonan-2-ol

ChEBI IDCHEBI:78304
ChEBI Namenonan-2-ol
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DefinitionA secondary alcohol that is nonane substituted by a hydroxy group at position 2.
Last Modified23 August 2023
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FormulaC9H20O
Net Charge0
Average Mass144.258
Monoisotopic Mass144.15142
SMILESCCCCCCCC(C)O
InChIInChI=1S/C9H20O/c1-3-4-5-6-7-8-9(2)10/h9-10H,3-8H2,1-2H3
InChIKeyNGDNVOAEIVQRFH-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Vitis vinifera (ncbitaxon:29760) - MetaboLights (MTBLS212)
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (17314143)
Starmerella bacillaris (ncbitaxon:1247836) - MetaboLights (MTBLS212)
Asaia lannensis (ncbitaxon:415421) - PubMed (31108760 )
Roles Classification
Biological Roles:
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
pheromone  A semiochemical used in olfactory communication between organisms of the same species eliciting a change in sexual or social behaviour.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
rat metabolite  Any mammalian metabolite produced during a metabolic reaction in rat (Rattus norvegicus).
plant metabolite  Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.
volatile oil component  Any plant metabolite that is found naturally as a component of a volatile oil.
Application:
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
ChEBI Ontology
Outgoing Relation(s)
nonan-2-ol (CHEBI:78304) has role bacterial metabolite (CHEBI:76969)
nonan-2-ol (CHEBI:78304) has role flavouring agent (CHEBI:35617)
nonan-2-ol (CHEBI:78304) has role pheromone (CHEBI:26013)
nonan-2-ol (CHEBI:78304) has role plant metabolite (CHEBI:76924)
nonan-2-ol (CHEBI:78304) has role rat metabolite (CHEBI:86264)
nonan-2-ol (CHEBI:78304) has role volatile oil component (CHEBI:27311)
nonan-2-ol (CHEBI:78304) is a nonanol (CHEBI:195604)
nonan-2-ol (CHEBI:78304) is a secondary alcohol (CHEBI:35681)
Incoming Relation(s)
(S)-1'-methyloctyl caffeate (CHEBI:70484) has functional parent nonan-2-ol (CHEBI:78304)
IUPAC Name 
nonan-2-ol
Synonyms  Source
1-methyl-1-octanolChEBI
methyl heptyl carbinolChemIDplus
2-hydroxynonaneChEBI
2-nonyl alcoholChEBI
nonanol-(2)NIST Chemistry WebBook
heptyl methyl carbinolHMDB
Manual XrefsDatabases
2-NonanolWikipedia
HMDB0033916HMDB
FDB012114FooDB
LMFA05000619LIPID MAPS
Registry NumbersSources
Reaxys:1719466Reaxys
CAS:628-99-9NIST Chemistry WebBook
CAS:628-99-9ChemIDplus
Citations