CHEBI:174281 - 7-Hydroxy-6-(methoxyacetyl)-2,2-dimethyl-2H-1-benzopyran

ChEBI IDCHEBI:174281
ChEBI Name7-Hydroxy-6-(methoxyacetyl)-2,2-dimethyl-2H-1-benzopyran
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC14H16O4
Net Charge0
Average Mass248.278
Monoisotopic Mass248.10486
SMILESCOCC(=O)c1cc2c(cc1O)OC(C)(C)C=C2
InChIInChI=1S/C14H16O4/c1-14(2)5-4-9-6-10(12(16)8-17-3)11(15)7-13(9)18-14/h4-7,15H,8H2,1-3H3
InChIKeyTZTBQYUROLBSLN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
7-Hydroxy-6-(methoxyacetyl)-2,2-dimethyl-2H-1-benzopyran (CHEBI:174281) is a 1-benzopyran (CHEBI:38443)
IUPAC Name 
1-(7-hydroxy-2,2-dimethylchromen-6-yl)-2-methoxyethanone
Manual XrefsDatabases
HMDB0029774HMDB
30776787ChemSpider