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CHEBI:193465 - 5-hydroxy-8-(2-hydroxypropan-2-yl)-4-(1-hydroxypropyl)-2H,8H,9H-furo[2,3-h]chromen-2-one

ChEBI IDCHEBI:193465
ChEBI Name5-hydroxy-8-(2-hydroxypropan-2-yl)-4-(1-hydroxypropyl)-2H,8H,9H-furo[2,3-h]chromen-2-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H20O6
Net Charge0
Average Mass320.341
Monoisotopic Mass320.12599
SMILESCCC(O)c1cc(=O)oc2c3c(cc(O)c12)OC(C(C)(C)O)C3
InChIInChI=1S/C17H20O6/c1-4-10(18)8-6-14(20)23-16-9-5-13(17(2,3)21)22-12(9)7-11(19)15(8)16/h6-7,10,13,18-19,21H,4-5H2,1-3H3
InChIKeyFWRVRRHMRQJWAM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
5-hydroxy-8-(2-hydroxypropan-2-yl)-4-(1-hydroxypropyl)-2H,8H,9H-furo[2,3-h]chromen-2-one (CHEBI:193465) is a furanocoumarin (CHEBI:24128)
IUPAC Name 
5-hydroxy-8-(2-hydroxypropan-2-yl)-4-(1-hydroxypropyl)-8,9-dihydrouro[2,3-h]chromen-2-one
Manual XrefsDatabases
74852760ChemSpider