EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:166610 - 5,7,4'-Trihydroxyflavanone 7-sulfate

ChEBI IDCHEBI:166610
ChEBI Name5,7,4'-Trihydroxyflavanone 7-sulfate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC15H12O8S
Net Charge0
Average Mass352.320
Monoisotopic Mass352.02529
SMILESO=C1CC(c2ccc(O)cc2)Oc2cc(OS(=O)(=O)O)cc(O)c21
InChIInChI=1S/C15H12O8S/c16-9-3-1-8(2-4-9)13-7-12(18)15-11(17)5-10(6-14(15)22-13)23-24(19,20)21/h1-6,13,16-17H,7H2,(H,19,20,21)
InChIKeyLCXKYLMSILXZFG-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5,7,4'-Trihydroxyflavanone 7-sulfate (CHEBI:166610) is a flavanones (CHEBI:28863)
IUPAC Name 
[5-hydroxy-2-(4-hydroxyphenyl)-4-oxo-2,3-dihydrochromen-7-yl] hydrogen sulate
Manual XrefsDatabases
24846410ChemSpider
LMPK12140327LIPID MAPS