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CHEBI:170125 - Grifolin

ChEBI IDCHEBI:170125
ChEBI NameGrifolin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H32O2
Net Charge0
Average Mass328.496
Monoisotopic Mass328.24023
SMILESCC(C)=CCC/C(C)=C/CC/C(C)=C/Cc1c(O)cc(C)cc1O
InChIInChI=1S/C22H32O2/c1-16(2)8-6-9-17(3)10-7-11-18(4)12-13-20-21(23)14-19(5)15-22(20)24/h8,10,12,14-15,23-24H,6-7,9,11,13H2,1-5H3/b17-10+,18-12+
InChIKeyPZHNKNRPGLTZPO-VZRGJMDUSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
HeLa cell (BTO:0000567) MetaboLights (MTBLS78)
NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78)
HeLa cell;NIH-3T3 cell (BTO:0000944) MetaboLights (MTBLS78)
Mus musculus (ncbitaxon:10090) Hepa-RG cell (BTO:0005736) MetaboLights (MTBLS78) Strain: C57BL/6J [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
Grifolin (CHEBI:170125) is a sesquiterpenoid (CHEBI:26658)
IUPAC Name 
5-methyl-2-[(2E,6E)-3,7,11-trimethyldodeca-2,6,10-trienyl]benzene-1,3-diol
Manual XrefsDatabases
4522608ChemSpider
HMDB0030446HMDB