EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:183066 - Panicein A hydroquinone

ChEBI IDCHEBI:183066
ChEBI NamePanicein A hydroquinone
Stars
Last Modified22 August 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H28O3
Net Charge0
Average Mass340.463
Monoisotopic Mass340.20384
SMILESCOc1cc(C)c(CC/C(C)=C/Cc2cc(O)ccc2O)c(C)c1C
InChIInChI=1S/C22H28O3/c1-14(6-8-18-13-19(23)9-11-21(18)24)7-10-20-15(2)12-22(25-5)17(4)16(20)3/h6,9,11-13,23-24H,7-8,10H2,1-5H3/b14-6+
InChIKeyFFAKJAIQHPBXPV-MKMNVTDBSA-N
Species of MetaboliteComponentSourceComments
Haliclona mucosa (ncbitaxon:608209) Whole Organism (NCIT:C13413) MetaboLights (MTBLS638)
ChEBI Ontology
Outgoing Relation(s)
Panicein A hydroquinone (CHEBI:183066) is a monoterpenoid (CHEBI:25409)
IUPAC Name 
2-[(E)-5-(4-methoxy-2,3,6-trimethylphenyl)-3-methylpent-2-enyl]benzene-1,4-diol
Manual XrefsDatabases
4578360ChemSpider