EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:222476 - (2'S)-2-(2-acetoxypropyl)-7-hydroxy-5-methylchromone

ChEBI IDCHEBI:222476
ChEBI Name(2'S)-2-(2-acetoxypropyl)-7-hydroxy-5-methylchromone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H16O5
Net Charge0
Average Mass276.288
Monoisotopic Mass276.09977
SMILESCC(=O)O[C@@H](C)Cc1cc(=O)c2c(C)cc(O)cc2o1
InChIInChI=1S/C15H16O5/c1-8-4-11(17)6-14-15(8)13(18)7-12(20-14)5-9(2)19-10(3)16/h4,6-7,9,17H,5H2,1-3H3/t9-/m0/s1
InChIKeyLDQKKYPGWOLQIZ-VIFPVBQESA-N
Species of MetaboliteComponentSourceComments
Alternaria (ncbitaxon:5598) - PubMed (31182771)
ChEBI Ontology
Outgoing Relation(s)
(2'S)-2-(2-acetoxypropyl)-7-hydroxy-5-methylchromone (CHEBI:222476) is a chromones (CHEBI:23238)
IUPAC Name 
[(2S)-1-(7-hydroxy-5-methyl-4-oxochromen-2-yl)propan-2-yl] acetate