4'-O-methylpleoside (CHEBI:213941)

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CHEBI:213941 - 4'-O-methylpleoside

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ChEBI ID	CHEBI:213941
ChEBI Name	4'-O-methylpleoside
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C16H22O9
Net Charge	0
Average Mass	358.343
Monoisotopic Mass	358.12638
SMILES	COc1cc(O)c(C(C)=O)c(O[C@@H]2O[C@H](CO)[C@@H](OC)[C@H](O)[C@H]2O)c1
InChI	InChI=1S/C16H22O9/c1-7(18)12-9(19)4-8(22-2)5-10(12)24-16-14(21)13(20)15(23-3)11(6-17)25-16/h4-5,11,13-17,19-21H,6H2,1-3H3/t11-,13-,14-,15-,16-/m1/s1
InChIKey	QRJGJIRRLBJEKQ-JPIRQXTESA-N

Species of Metabolite	Component	Source	Comments
Aschersonia (ncbitaxon:100986)	-	PubMed (32376482)

ChEBI Ontology

Outgoing Relation(s)
	4'-O-methylpleoside (CHEBI:213941) is a glycoside (CHEBI:24400)

IUPAC Name
1-[2-[(2S,3R,4R,5S,6R)-3,4-dihydroxy-6-(hydroxymethyl)-5-methoxyoxan-2-yl]oxy-6-hydroxy-4-methoxyphenyl]ethanone