3,4,5-trihydroxy-6-{[5-(4-methoxyphenyl)-2-methyl-3-oxopent-4-en-2-yl]oxy}oxane-2-carboxylic acid (CHEBI:193513)

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CHEBI:193513 - 3,4,5-trihydroxy-6-{[5-(4-methoxyphenyl)-2-methyl-3-oxopent-4-en-2-yl]oxy}oxane-2-carboxylic acid

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ChEBI ID	CHEBI:193513
ChEBI Name	3,4,5-trihydroxy-6-{[5-(4-methoxyphenyl)-2-methyl-3-oxopent-4-en-2-yl]oxy}oxane-2-carboxylic acid
Stars
Submitter	mwilliams
Downloads	Molfile

Formula	C19H24O9
Net Charge	0
Average Mass	396.392
Monoisotopic Mass	396.14203
SMILES	COc1ccc(/C=C/C(=O)C(C)(C)OC2OC(C(=O)O)C(O)C(O)C2O)cc1
InChI	InChI=1S/C19H24O9/c1-19(2,12(20)9-6-10-4-7-11(26-3)8-5-10)28-18-15(23)13(21)14(22)16(27-18)17(24)25/h4-9,13-16,18,21-23H,1-3H3,(H,24,25)/b9-6+
InChIKey	UIUVTIDXCSPNAF-RMKNXTFCSA-N

Species of Metabolite	Component	Source	Comments
Homo sapiens (ncbitaxon:9606)	feces (BTO:0000440)	MetaboLights (MTBLS5335)

ChEBI Ontology

Outgoing Relation(s)
	3,4,5-trihydroxy-6-{[5-(4-methoxyphenyl)-2-methyl-3-oxopent-4-en-2-yl]oxy}oxane-2-carboxylic acid (CHEBI:193513) is a lipopolysaccharide (CHEBI:16412)