EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:190324 - Tridaxidone

ChEBI IDCHEBI:190324
ChEBI NameTridaxidone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC24H26O13
Net Charge0
Average Mass522.459
Monoisotopic Mass522.13734
SMILESCOc1ccc(-c2oc3cc(O[C@@H]4OC(CO)[C@@H](O)[C@H](O)C4O)c(OC)c(O)c3c(=O)c2OC)c(O)c1
InChIInChI=1S/C24H26O13/c1-32-9-4-5-10(11(26)6-9)21-23(34-3)18(29)15-12(35-21)7-13(22(33-2)17(15)28)36-24-20(31)19(30)16(27)14(8-25)37-24/h4-7,14,16,19-20,24-28,30-31H,8H2,1-3H3/t14?,16-,19+,20?,24-/m1/s1
InChIKeyGGWQEKOBVMCBHI-NIZXRZDQSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) intestinal content (NCIT:C189653) MetaboLights (MTBLS4101) Strain: C57BL/6J  [EFO:0000606]
ChEBI Ontology
Outgoing Relation(s)
Tridaxidone (CHEBI:190324) is a flavonoids (CHEBI:72544)
Tridaxidone (CHEBI:190324) is a glycoside (CHEBI:24400)
IUPAC Name 
5-hydroxy-2-(2-hydroxy-4-methoxyphenyl)-3,6-dimethoxy-7-[(2S,4S,5S)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxychromen-4-one
Manual XrefsDatabases
LMPK12113047LIPID MAPS
24845609ChemSpider