EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:860 - 2,2-Dimethyl-8-prenylchromene 6-carboxylic acid

ChEBI IDCHEBI:860
ChEBI Name2,2-Dimethyl-8-prenylchromene 6-carboxylic acid
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC17H20O3
Net Charge0
Average Mass272.344
Monoisotopic Mass272.14124
SMILESCC(C)=CCc1cc(C(=O)O)cc2c1OC(C)(C)C=C2
InChIInChI=1S/C17H20O3/c1-11(2)5-6-12-9-14(16(18)19)10-13-7-8-17(3,4)20-15(12)13/h5,7-10H,6H2,1-4H3,(H,18,19)
InChIKeyMCQWYGYDCGLCJD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2,2-Dimethyl-8-prenylchromene 6-carboxylic acid (CHEBI:860) is a 1-benzopyran (CHEBI:38443)
Synonym  Source
2,2-Dimethyl-8-prenylchromene 6-carboxylic acidKEGG COMPOUND
Manual XrefsDatabases
C09003KEGG COMPOUND
C00002424KNApSAcK
Registry NumbersSources
CAS:151731-50-9KEGG COMPOUND