(2'S)-2-(propan-2'-ol)-5-hydroxy-benzopyran-4-one (CHEBI:198156)

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CHEBI:198156 - (2'S)-2-(propan-2'-ol)-5-hydroxy-benzopyran-4-one

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ChEBI ID	CHEBI:198156
ChEBI Name	(2'S)-2-(propan-2'-ol)-5-hydroxy-benzopyran-4-one
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Submitter	MetaboLights
Downloads	Molfile

Formula	C12H12O4
Net Charge	0
Average Mass	220.224
Monoisotopic Mass	220.07356
SMILES	C[C@@H](O)Cc1cc(=O)c2c(O)cccc2o1
InChI	InChI=1S/C12H12O4/c1-7(13)5-8-6-10(15)12-9(14)3-2-4-11(12)16-8/h2-4,6-7,13-14H,5H2,1H3/t7-/m1/s1
InChIKey	BEBIIRLVYJMQOS-SSDOTTSWSA-N

Species of Metabolite	Component	Source	Comments
Curvulariaspecies (ncbitaxon:1715225)	-	PubMed (16038954)

ChEBI Ontology

Outgoing Relation(s)
	(2'S)-2-(propan-2'-ol)-5-hydroxy-benzopyran-4-one (CHEBI:198156) is a chromones (CHEBI:23238)

IUPAC Name
5-hydroxy-2-[(2R)-2-hydroxypropyl]chromen-4-one

Manual Xrefs	Databases
9847721	ChemSpider