pterolinus A (CHEBI:67381)

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ChEBI Name	pterolinus A

ChEBI ID	CHEBI:67381

Definition	A member of the class of 1-benzofurans that is 1-benzofuran substituted by a hydroxy group at position 5, a methoxy group at position 6, a 3-hydroxy-4-methoxyphenyl group at position 3 and a methyl group at position 2. Isolated from Pterocarpus santalinus, it exhibits anti-inflammatory activity.

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

Supplier Information	ChemicalBook:CB21387988, ZINC000006090922

Download	Molfile XML SDF

Formula

C17H16O5

Net Charge

Average Mass

300.30590

Monoisotopic Mass

300.09977

InChI

InChI=1S/C17H16O5/c1-9-17(10-4-5-14(20-2)12(18)6-10)11-7-13(19)16(21-3)8-15(11)22-9/h4-8,18-19H,1-3H3

InChIKey

ZQLLSZOQHBGUJG-UHFFFAOYSA-N

SMILES

COc1ccc(cc1O)-c1c(C)oc2cc(OC)c(O)cc12

Metabolite of Species	Details
Pterocarpus santalinus (NCBI:txid1071199)	Found in heartwood (PO:0004512). Dichloromethane soluble portion of MeOH extract of powdered heartwood See: PubMed

Roles Classification
Biological Role(s):	plant metabolite Any eukaryotic metabolite produced during a metabolic reaction in plants, the kingdom that include flowering plants, conifers and other gymnosperms.

Application(s):	anti-inflammatory agent Any compound that has anti-inflammatory effects.

ChEBI Ontology
Outgoing	pterolinus A (CHEBI:67381) has role anti-inflammatory agent (CHEBI:67079) pterolinus A (CHEBI:67381) has role plant metabolite (CHEBI:76924) pterolinus A (CHEBI:67381) is a 1-benzofurans (CHEBI:38830) pterolinus A (CHEBI:67381) is a aromatic ether (CHEBI:35618) pterolinus A (CHEBI:67381) is a polyphenol (CHEBI:26195)

IUPAC Name

3-(3-hydroxy-4-methoxyphenyl)-6-methoxy-2-methyl-1-benzofuran-5-ol

Registry Number	Type	Source
21548611	Reaxys Registry Number	Reaxys

Citation	Type	Source
21488654	PubMed citation	Europe PMC

Last Modified

09 January 2014