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

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

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

ChEBI ID	CHEBI:193465

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H20O6

Net Charge

Average Mass

320.341

Monoisotopic Mass

320.12599

InChI

InChI=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

InChIKey

FWRVRRHMRQJWAM-UHFFFAOYSA-N

SMILES

O1C(CC2=C1C=C(O)C3=C2OC(=O)C=C3C(O)CC)C(O)(C)C

Metabolite of Species	Details
Homo sapiens (NCBI:txid9606)	Found in feces (BTO:0000440). See: MetaboLights Study

ChEBI Ontology
Outgoing	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