EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:188638 - 2,8-Dihydroxy-4-isopropyl-3-methoxy-6-methyl-1-naphthaldehyde

Default Structure
ChEBI IDCHEBI:188638
ChEBI Name2,8-Dihydroxy-4-isopropyl-3-methoxy-6-methyl-1-naphthaldehyde
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H18O4
Net Charge0
Average Mass274.316
Monoisotopic Mass274.12051
SMILESCOc1c(O)c(C=O)c2c(O)cc(C)cc2c1C(C)C
InChIInChI=1S/C16H18O4/c1-8(2)13-10-5-9(3)6-12(18)14(10)11(7-17)15(19)16(13)20-4/h5-8,18-19H,1-4H3
InChIKeyXOXRFBVTHNRDNY-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
2,8-Dihydroxy-4-isopropyl-3-methoxy-6-methyl-1-naphthaldehyde (CHEBI:188638) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
2,8-dihydroxy-3-methoxy-6-methyl-4-propan-2-ylnaphthalene-1-carbaldehyde
Manual XrefsDatabases
541852ChemSpider