EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:168225 - Luteolin 7,3'-dimethyl ether 5-glucoside

ChEBI IDCHEBI:168225
ChEBI NameLuteolin 7,3'-dimethyl ether 5-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26O10
Net Charge0
Average Mass474.462
Monoisotopic Mass474.15260
SMILESCCC1O[C@@H](Oc2cc(OC)cc3oc(-c4ccc(O)c(OC)c4)cc(=O)c23)C(O)[C@@H](O)[C@@H]1O
InChIInChI=1S/C24H26O10/c1-4-15-21(27)22(28)23(29)24(33-15)34-19-9-12(30-2)8-18-20(19)14(26)10-16(32-18)11-5-6-13(25)17(7-11)31-3/h5-10,15,21-25,27-29H,4H2,1-3H3/t15?,21-,22+,23?,24+/m1/s1
InChIKeyNBFYCUPKRNEACE-GCDDADHNSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Luteolin 7,3'-dimethyl ether 5-glucoside (CHEBI:168225) is a flavonoids (CHEBI:72544)
Luteolin 7,3'-dimethyl ether 5-glucoside (CHEBI:168225) is a glycoside (CHEBI:24400)
IUPAC Name 
5-[(2S,4S,5S)-6-ethyl-3,4,5-trihydroxyoxan-2-yl]oxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxychromen-4-one
Manual XrefsDatabases
LMPK12111050LIPID MAPS
24844004ChemSpider