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CHEBI:172641 - Shoyuflavone B

ChEBI IDCHEBI:172641
ChEBI NameShoyuflavone B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H14O10
Net Charge0
Average Mass402.311
Monoisotopic Mass402.05870
SMILESO=C(O)C(O)C(Oc1cc(O)c2c(=O)c(-c3ccc(O)cc3)coc2c1)C(=O)O
InChIInChI=1S/C19H14O10/c20-9-3-1-8(2-4-9)11-7-28-13-6-10(5-12(21)14(13)15(11)22)29-17(19(26)27)16(23)18(24)25/h1-7,16-17,20-21,23H,(H,24,25)(H,26,27)
InChIKeyYZECNQRIFYQRPI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2633)
ChEBI Ontology
Outgoing Relation(s)
Shoyuflavone B (CHEBI:172641) is a isoflavones (CHEBI:38757)
IUPAC Name 
2-hydroxy-3-[5-hydroxy-3-(4-hydroxyphenyl)-4-oxochromen-7-yl]oxybutanedioic acid
Manual XrefsDatabases
HMDB0034589HMDB
8176726ChemSpider