5-methylorsellinic acid (CHEBI:146307)

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ChEBI Name	5-methylorsellinic acid

ChEBI ID	CHEBI:146307

Definition	A dihydroxybenzoic acid that is o-orsellinic acid in which the hydrogen at position 5 is substituted by a methyl group.

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

Supplier Information

Download	Molfile XML SDF

Formula

C9H10O4

Net Charge

Average Mass

182.175

Monoisotopic Mass

182.05791

InChI

InChI=1S/C9H10O4/c1-4-5(2)8(9(12)13)7(11)3-6(4)10/h3,10-11H,1-2H3,(H,12,13)

InChIKey

GIBRZOCMRFRCOQ-UHFFFAOYSA-N

SMILES

C=1(C=C(C(=C(C1C)C)C(=O)O)O)O

Metabolite of Species	Details
Byssochlamys nivea (NCBI:txid5093)	Found in cell suspension culture (BTO:0000221). 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):	fungal metabolite Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.

ChEBI Ontology
Outgoing	5-methylorsellinic acid (CHEBI:146307) has functional parent o-orsellinic acid (CHEBI:32807) 5-methylorsellinic acid (CHEBI:146307) has role fungal metabolite (CHEBI:76946) 5-methylorsellinic acid (CHEBI:146307) is a dihydroxybenzoic acid (CHEBI:23778) 5-methylorsellinic acid (CHEBI:146307) is a resorcinols (CHEBI:33572) 5-methylorsellinic acid (CHEBI:146307) is conjugate acid of 5-methylorsellinate (CHEBI:146172)

Incoming	5-methylorsellinate (CHEBI:146172) is conjugate base of 5-methylorsellinic acid (CHEBI:146307)

IUPAC Name

4,6-dihydroxy-2,3-dimethylbenzoic acid

Synonyms	Sources
2,4-dihydroxy-5,6-dimethylbenzoic acid	ChEBI
5-methylorsellinic acid	ChEBI

Registry Number	Type	Source
519-42-6	CAS Registry Number	ChEBI

Last Modified

12 March 2020