5-(3-methoxy-3-oxopropyl)-furan-2-carboxylic acid (CHEBI:207582)

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CHEBI:207582 - 5-(3-methoxy-3-oxopropyl)-furan-2-carboxylic acid

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ChEBI ID	CHEBI:207582
ChEBI Name	5-(3-methoxy-3-oxopropyl)-furan-2-carboxylic acid
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C9H10O5
Net Charge	0
Average Mass	198.174
Monoisotopic Mass	198.05282
SMILES	COC(=O)CCc1ccc(C(=O)O)o1
InChI	InChI=1S/C9H10O5/c1-13-8(10)5-3-6-2-4-7(14-6)9(11)12/h2,4H,3,5H2,1H3,(H,11,12)
InChIKey	QSGYIHKOMDFVDJ-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Coriolopsis (ncbitaxon:76125)	-	PubMed (28208775)

Roles Classification

Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Brønsted base).

ChEBI Ontology

Outgoing Relation(s)
	5-(3-methoxy-3-oxopropyl)-furan-2-carboxylic acid (CHEBI:207582) is a furoic acid (CHEBI:36055)

IUPAC Name
5-(3-methoxy-3-oxopropyl)uran-2-carboxylic acid

Manual Xrefs	Databases
61360279	ChemSpider