EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:174823 - Parakmerin A

ChEBI IDCHEBI:174823
ChEBI NameParakmerin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H20O3
Net Charge0
Average Mass296.366
Monoisotopic Mass296.14124
SMILESC/C=C/c1ccc2c(c1)C(C)C(c1ccc(O)c(OC)c1)O2
InChIInChI=1S/C19H20O3/c1-4-5-13-6-9-17-15(10-13)12(2)19(22-17)14-7-8-16(20)18(11-14)21-3/h4-12,19-20H,1-3H3/b5-4+
InChIKeyFCFVMNGCSPIORZ-SNAWJCMRSA-N
ChEBI Ontology
Outgoing Relation(s)
Parakmerin A (CHEBI:174823) is a benzofurans (CHEBI:35259)
IUPAC Name 
2-methoxy-4-[3-methyl-5-[(E)-prop-1-enyl]-2,3-dihydro-1-benzouran-2-yl]phenol
Manual XrefsDatabases
HMDB0033950HMDB
35013679ChemSpider