(4R,5S,6R)-4,5,6-trihydroxy-3-methoxy-5-methyl-cyclohex-2-en-1-one (CHEBI:226456)

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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	(4R,5S,6R)-4,5,6-trihydroxy-3-methoxy-5-methyl-cyclohex-2-en-1-one

ChEBI ID	CHEBI:226456

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C8H12O5

Net Charge

Average Mass

188.179

Monoisotopic Mass

188.06847

InChI

InChI=1S/C8H12O5/c1-8(12)6(10)4(9)3-5(13-2)7(8)11/h3,6-7,10-12H,1-2H3/t6-,7-,8+/m0/s1

InChIKey

CQQQJOUVFXTXRF-BIIVOSGPSA-N

SMILES

O=C1C=C(OC)[C@H](O)[C@@]([C@H]1O)(O)C

ChEBI Ontology
Outgoing	(4R,5S,6R)-4,5,6-trihydroxy-3-methoxy-5-methyl-cyclohex-2-en-1-one (CHEBI:226456) is a cyclohexenones (CHEBI:48953)

IUPAC Name

(4R,5S,6R)-4,5,6-trihydroxy-3-methoxy-5-methylcyclohex-2-en-1-one