5-hydroxymethyl-2-furoic acid (CHEBI:89118)

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ChEBI Name	5-hydroxymethyl-2-furoic acid

ChEBI ID	CHEBI:89118

Definition	A member of the class of furoic acids that is 2-furoic acid substituted at position 5 by a hydroxymethyl group.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C6H6O4

Net Charge

Average Mass

142.110

Monoisotopic Mass

142.02661

InChI

InChI=1S/C6H6O4/c7-3-4-1-2-5(10-4)6(8)9/h1-2,7H,3H2,(H,8,9)

InChIKey

PCSKKIUURRTAEM-UHFFFAOYSA-N

SMILES

OCC=1OC(C(O)=O)=CC1

Metabolite of Species	Details
Komagataeibacter xylinus (NCBI:txid28448)	See: PubMed
Aspergillus sp. (NCBI:txid5065)	See: PubMed
Homo sapiens (NCBI:txid9606)	Found in urine (BTO:0001419). See: PubMed
Homo sapiens (NCBI:txid9606)	Found in faeces (UBERON:0001988). See: PubMed
Homo sapiens (NCBI:txid9606)	See: MetaboLights Study
Homo sapiens (NCBI:txid9606)	See: PubMed

Roles Classification
Chemical Role(s):	Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid )

Biological Role(s):	human urinary metabolite Any metabolite (endogenous or exogenous) found in human urine samples. bacterial xenobiotic metabolite Any bacterial metabolite produced by metabolism of a xenobiotic compound in bacteria. fungal metabolite Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.

Application(s):	nematicide A substance used to destroy pests of the phylum Nematoda (roundworms).

ChEBI Ontology
Outgoing	5-hydroxymethyl-2-furoic acid (CHEBI:89118) has role bacterial xenobiotic metabolite (CHEBI:76976) 5-hydroxymethyl-2-furoic acid (CHEBI:89118) has role fungal metabolite (CHEBI:76946) 5-hydroxymethyl-2-furoic acid (CHEBI:89118) has role human urinary metabolite (CHEBI:84087) 5-hydroxymethyl-2-furoic acid (CHEBI:89118) has role nematicide (CHEBI:25491) 5-hydroxymethyl-2-furoic acid (CHEBI:89118) is a aromatic primary alcohol (CHEBI:33857) 5-hydroxymethyl-2-furoic acid (CHEBI:89118) is a furoic acid (CHEBI:36055)

IUPAC Name

5-(hydroxymethyl)furan-2-carboxylic acid

Synonyms	Sources
5-(Hydroxymethyl)-2-furoic acid	HMDB
5-Hydroxymethyl-2-furancarboxylic acid	HMDB
5-Hydroxymethyl-furan-2-carboxylic acid	HMDB
5-Hydroxymethylfuran-2-carboxylic acid	HMDB
5-Hydroxymethylfuranoic acid	HMDB
5-Hydroxymethylfuroic acid	HMDB
Sumiki's acid	HMDB

Last Modified

07 April 2016