(3R,4R)-cis-4-hydroxy-5-methylmellein (CHEBI:224491)

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CHEBI:224491 - (3R,4R)-cis-4-hydroxy-5-methylmellein

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ChEBI ID	CHEBI:224491
ChEBI Name	(3R,4R)-cis-4-hydroxy-5-methylmellein
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C11H12O4
Net Charge	0
Average Mass	208.213
Monoisotopic Mass	208.07356
SMILES	Cc1ccc(O)c2c1[C@@H](O)[C@@H](C)OC2=O
InChI	InChI=1S/C11H12O4/c1-5-3-4-7(12)9-8(5)10(13)6(2)15-11(9)14/h3-4,6,10,12-13H,1-2H3/t6-,10+/m1/s1
InChIKey	GFURKEBFQCFPFH-LDWIPMOCSA-N

Species of Metabolite	Component	Source	Comments
Cytospora ceratosperma (ncbitaxon:1928361)	-	DOI (10.1080/00021369.1986.10867484)

ChEBI Ontology

Outgoing Relation(s)
	(3R,4R)-cis-4-hydroxy-5-methylmellein (CHEBI:224491) is a 2-benzopyran (CHEBI:38444)

IUPAC Name
(3R,4R)-4,8-dihydroxy-3,5-dimethyl-3,4-dihydroisochromen-1-one

Manual Xrefs	Databases
67492472	ChemSpider