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CHEBI:175130 - R-4'-Hydroxywarfarin

Default Structure
ChEBI IDCHEBI:175130
ChEBI NameR-4'-Hydroxywarfarin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H16O5
Net Charge0
Average Mass324.332
Monoisotopic Mass324.09977
SMILESCC(=O)C[C@H](c1ccc(O)cc1)c1c(O)c2ccccc2oc1=O
InChIInChI=1S/C19H16O5/c1-11(20)10-15(12-6-8-13(21)9-7-12)17-18(22)14-4-2-3-5-16(14)24-19(17)23/h2-9,15,21-22H,10H2,1H3/t15-/m1/s1
InChIKeyRRZWAMPDGRWRPF-OAHLLOKOSA-N
ChEBI Ontology
Outgoing Relation(s)
R-4'-Hydroxywarfarin (CHEBI:175130) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
4-hydroxy-3-[(1R)-1-(4-hydroxyphenyl)-3-oxobutyl]chromen-2-one
Manual XrefsDatabases
48060783ChemSpider
Registry NumbersSources
CAS:63740-78-3ChemIDplus