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CHEBI:196337 - 8-Hydroxy-R-acenocoumarol

ChEBI IDCHEBI:196337
ChEBI Name8-Hydroxy-R-acenocoumarol
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SubmitterMetaboLights
DownloadsMolfile
FormulaC19H15NO7
Net Charge0
Average Mass369.329
Monoisotopic Mass369.08485
SMILESCC(=O)C[C@@H](c1ccc([N+](=O)[O-])cc1)c1c(O)c2cccc(O)c2oc1=O
InChIInChI=1S/C19H15NO7/c1-10(21)9-14(11-5-7-12(8-6-11)20(25)26)16-17(23)13-3-2-4-15(22)18(13)27-19(16)24/h2-8,14,22-23H,9H2,1H3/t14-/m0/s1
InChIKeyRXFXXWMNPIVMHP-AWEZNQCLSA-N
ChEBI Ontology
Outgoing Relation(s)
8-Hydroxy-R-acenocoumarol (CHEBI:196337) is a hydroxycoumarin (CHEBI:37912)
IUPAC Name 
4,8-dihydroxy-3-[(1S)-1-(4-nitrophenyl)-3-oxobutyl]chromen-2-one
Manual XrefsDatabases
30778602ChemSpider
HMDB0060884HMDB