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CHEBI:168034 - DB-2073

ChEBI IDCHEBI:168034
ChEBI NameDB-2073
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H24O2
Net Charge0
Average Mass236.355
Monoisotopic Mass236.17763
SMILESCCCCCCc1c(O)cc(CCC)cc1O
InChIInChI=1S/C15H24O2/c1-3-5-6-7-9-13-14(16)10-12(8-4-2)11-15(13)17/h10-11,16-17H,3-9H2,1-2H3
InChIKeyVERGPVBZPMTZDY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
DB-2073 (CHEBI:168034) is a alkylbenzene (CHEBI:38976)
IUPAC Name 
2-hexyl-5-propylbenzene-1,3-diol
Manual XrefsDatabases
170764ChemSpider
LMPK15030002LIPID MAPS
Registry NumbersSources
CAS:39341-78-1ChemIDplus