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CHEBI:173131 - 5,7-dihydroxy-2-[7-hydroxy-2-(hydroxymethyl)-2-(4-methylpent-3-en-1-yl)-2H-chromen-6-yl]-3,4-dihydro-2H-1-benzopyran-4-one

Default Structure
ChEBI IDCHEBI:173131
ChEBI Name5,7-dihydroxy-2-[7-hydroxy-2-(hydroxymethyl)-2-(4-methylpent-3-en-1-yl)-2H-chromen-6-yl]-3,4-dihydro-2H-1-benzopyran-4-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC25H26O7
Net Charge0
Average Mass438.476
Monoisotopic Mass438.16785
SMILESCC(C)=CCCC1(CO)C=Cc2cc(C3CC(=O)c4c(O)cc(O)cc4O3)c(O)cc2O1
InChIInChI=1S/C25H26O7/c1-14(2)4-3-6-25(13-26)7-5-15-8-17(18(28)11-21(15)32-25)22-12-20(30)24-19(29)9-16(27)10-23(24)31-22/h4-5,7-11,22,26-29H,3,6,12-13H2,1-2H3
InChIKeyISLXOQLYOVJTQL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Rattus norvegicus (ncbitaxon:10116) feces (BTO:0000440) MetaboLights (MTBLS2721)
ChEBI Ontology
Outgoing Relation(s)
5,7-dihydroxy-2-[7-hydroxy-2-(hydroxymethyl)-2-(4-methylpent-3-en-1-yl)-2H-chromen-6-yl]-3,4-dihydro-2H-1-benzopyran-4-one (CHEBI:173131) is a extended flavonoid (CHEBI:71037)
IUPAC Name 
5,7-dihydroxy-2-[7-hydroxy-2-(hydroxymethyl)-2-(4-methylpent-3-enyl)chromen-6-yl]-2,3-dihydrochromen-4-one
Manual XrefsDatabases
74853000ChemSpider