EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:187530 - Flavaprenin 7,4'-diglucoside

Default Structure
ChEBI IDCHEBI:187530
ChEBI NameFlavaprenin 7,4'-diglucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC32H40O15
Net Charge0
Average Mass664.657
Monoisotopic Mass664.23672
SMILESCC(C)=CCc1c(OC2OC(CO)C(O)C(O)C2O)cc(O)c2c1OC(c1ccc(OC3OC(CO)C(O)C(O)C3O)cc1)CC2=O
InChIInChI=1S/C32H40O15/c1-13(2)3-8-16-20(45-32-29(42)27(40)25(38)22(12-34)47-32)10-18(36)23-17(35)9-19(44-30(16)23)14-4-6-15(7-5-14)43-31-28(41)26(39)24(37)21(11-33)46-31/h3-7,10,19,21-22,24-29,31-34,36-42H,8-9,11-12H2,1-2H3
InChIKeySWHOWAZBASIDAD-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
Flavaprenin 7,4'-diglucoside (CHEBI:187530) is a flavonoids (CHEBI:72544)
Flavaprenin 7,4'-diglucoside (CHEBI:187530) is a glycoside (CHEBI:24400)
IUPAC Name 
5-hydroxy-8-(3-methylbut-2-enyl)-7-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-[4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846347ChemSpider
LMPK12140228LIPID MAPS