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CHEBI:185710 - Broussoflavonol B

ChEBI IDCHEBI:185710
ChEBI NameBroussoflavonol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H28O7
Net Charge0
Average Mass452.503
Monoisotopic Mass452.18350
SMILESCOc1c(-c2ccc(O)c(O)c2)oc2c(CC=C(C)C)c(O)c(CC=C(C)C)c(O)c2c1=O
InChIInChI=1S/C26H28O7/c1-13(2)6-9-16-21(29)17(10-7-14(3)4)25-20(22(16)30)23(31)26(32-5)24(33-25)15-8-11-18(27)19(28)12-15/h6-8,11-12,27-30H,9-10H2,1-5H3
InChIKeyWKVKAWWZXXTJEH-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)
Broussoflavonol B (CHEBI:185710) is a flavones (CHEBI:24043)
IUPAC Name 
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-methoxy-6,8-bis(3-methylbut-2-enyl)chromen-4-one
Manual XrefsDatabases
LMPK12112720LIPID MAPS
421881ChemSpider
Registry NumbersSources
CAS:99217-70-6ChemIDplus