EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:175606 - 5-Deoxykievitone hydrate

ChEBI IDCHEBI:175606
ChEBI Name5-Deoxykievitone hydrate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H22O6
Net Charge0
Average Mass358.390
Monoisotopic Mass358.14164
SMILESCC(C)(O)CCc1c(O)ccc2c1OCC(c1ccc(O)cc1O)C2=O
InChIInChI=1S/C20H22O6/c1-20(2,25)8-7-13-16(22)6-5-14-18(24)15(10-26-19(13)14)12-4-3-11(21)9-17(12)23/h3-6,9,15,21-23,25H,7-8,10H2,1-2H3
InChIKeyBYQKGWSQMLLYGJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
5-Deoxykievitone hydrate (CHEBI:175606) is a isoflavanones (CHEBI:38741)
IUPAC Name 
3-(2,4-dihydroxyphenyl)-7-hydroxy-8-(3-hydroxy-3-methylbutyl)-2,3-dihydrochromen-4-one
Manual XrefsDatabases
LMPK12050459LIPID MAPS
24842910ChemSpider
HMDB0038113HMDB