TAN-931 (CHEBI:69475)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	TAN-931

ChEBI ID	CHEBI:69475

Definition	A member of the class of benzoic acids that is benzoic acid substituted by a formyl group at position 3, a hydroxy group at position 5 and a 2,6-dihydroxybenzoyl group at position 4. Isolated from Penicillium purpurogenum, it exhibits antiviral activity.

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

Supplier Information	ZINC000000004360

Download	Molfile XML SDF

Formula

C15H10O7

Net Charge

Average Mass

302.23570

Monoisotopic Mass

302.04265

InChI

InChI=1S/C15H10O7/c16-6-8-4-7(15(21)22)5-11(19)12(8)14(20)13-9(17)2-1-3-10(13)18/h1-6,17-19H,(H,21,22)

InChIKey

INVAPAXTQZQLGN-UHFFFAOYSA-N

SMILES

OC(=O)c1cc(O)c(C(=O)c2c(O)cccc2O)c(C=O)c1

Metabolite of Species	Details
Penicillium purpurogenum (NCBI:txid28575)	Found in mycelium (BTO:0001436). Ethylacetate extract of fermentation broth and acetone extract of mycelia of strain JS03 21 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):	antiviral agent A substance that destroys or inhibits replication of viruses. EC 1.14.14.14 (aromatase) inhibitor An EC 1.14.14.* (oxidoreductase acting on paired donors, incorporating of 1 atom of oxygen, with reduced flavin or flavoprotein as one donor) inhibitor which interferes with the action of aromatase (EC 1.14.14.14) and so reduces production of estrogenic steroid hormones. Penicillium metabolite Any fungal metabolite produced during a metabolic reaction in Penicillium.

ChEBI Ontology
Outgoing	TAN-931 (CHEBI:69475) has role Penicillium metabolite (CHEBI:76964) TAN-931 (CHEBI:69475) has role antiviral agent (CHEBI:22587) TAN-931 (CHEBI:69475) has role EC 1.14.14.14 (aromatase) inhibitor (CHEBI:50790) TAN-931 (CHEBI:69475) is a benzaldehydes (CHEBI:22698) TAN-931 (CHEBI:69475) is a benzoic acids (CHEBI:22723) TAN-931 (CHEBI:69475) is a benzophenones (CHEBI:22726) TAN-931 (CHEBI:69475) is a resorcinols (CHEBI:33572)

IUPAC Name

4-(2,6-dihydroxybenzoyl)-3-formyl-5-hydroxybenzoic acid

Synonym	Source
Tan 931	ChemIDplus

Citations

Last Modified

13 January 2014