CHEBI:77930 - undecan-2-ol

ChEBI IDCHEBI:77930
ChEBI Nameundecan-2-ol
Stars
DefinitionA secondary alcohol that is undecane substituted by a hydroxy group at position 2.
Last Modified24 August 2023
SubmitterTrudy
DownloadsMolfile
FormulaC11H24O
Net Charge0
Average Mass172.312
Monoisotopic Mass172.18272
SMILESCCCCCCCCCC(C)O
InChIInChI=1S/C11H24O/c1-3-4-5-6-7-8-9-10-11(2)12/h11-12H,3-10H2,1-2H3
InChIKeyXMUJIPOFTAHSOK-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) faeces (UBERON:0001988) PubMed (17314143)
Starmerella bacillaris (ncbitaxon:1247836) - MetaboLights (MTBLS212)
Vitis vinifera (ncbitaxon:29760) - MetaboLights (MTBLS212)
Prunus dulcis (ncbitaxon:3755) - PubMed (19344182)
Lobiopa insularis (ncbitaxon:1970893) - PubMed (28601940)
Roles Classification
Biological Roles:
pheromone  A semiochemical used in olfactory communication between organisms of the same species eliciting a change in sexual or social behaviour.
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.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
animal metabolite  Any eukaryotic metabolite produced during a metabolic reaction in animals that include diverse creatures from sponges, insects to mammals.
Application:
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
ChEBI Ontology
Outgoing Relation(s)
undecan-2-ol (CHEBI:77930) has role animal metabolite (CHEBI:75767)
undecan-2-ol (CHEBI:77930) has role flavouring agent (CHEBI:35617)
undecan-2-ol (CHEBI:77930) has role pheromone (CHEBI:26013)
undecan-2-ol (CHEBI:77930) has role plant metabolite (CHEBI:76924)
undecan-2-ol (CHEBI:77930) has role volatile oil component (CHEBI:27311)
undecan-2-ol (CHEBI:77930) is a secondary alcohol (CHEBI:35681)
undecan-2-ol (CHEBI:77930) is a undecanol (CHEBI:195608)
IUPAC Name 
undecan-2-ol
Synonyms  Source
2-undecanolSUBMITTER
methyl nonyl carbinolSUBMITTER
2-hendecanolSUBMITTER
2-hydroxyundecaneChemIDplus
sec-undecyl alcoholHMDB
α-methyldecanolChEBI
Manual XrefsDatabases
HMDB0030942HMDB
FDB002918FooDB
LMFA05000621LIPID MAPS
Registry NumbersSources
Reaxys:1719795Reaxys
CAS:1653-30-1ChemIDplus
CAS:1653-30-1NIST Chemistry WebBook
Citations