psoralen (CHEBI:27616)

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ChEBI Name	psoralen

ChEBI ID	CHEBI:27616

Definition	The simplest member of the class of psoralens that is 7H-furo[3,2-g]chromene having a keto group at position 7. It has been found in plants like Psoralea corylifolia and Ficus salicifolia.

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

Secondary ChEBI IDs	CHEBI:378534, CHEBI:26368, CHEBI:8615

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Formulae

C11H6O3
C11H6O3

Net Charge

Average Mass

186.16354

Monoisotopic Mass

186.03169

InChI

InChI=1S/C11H6O3/c12-11-2-1-7-5-8-3-4-13-9(8)6-10(7)14-11/h1-6H

InChIKey

ZCCUUQDIBDJBTK-UHFFFAOYSA-N

SMILES

O=c1ccc2cc3ccoc3cc2o1

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.

ChEBI Ontology
Outgoing	psoralen (CHEBI:27616) has role plant metabolite (CHEBI:76924) psoralen (CHEBI:27616) is a psoralens (CHEBI:26369)

Incoming	5-methoxy-8-(2'-hydroxy-3'-buthoxy-3'-methylbutyloxy)psoralen (CHEBI:66697) has functional parent psoralen (CHEBI:27616) 5-methoxypsoralen (CHEBI:18293) has functional parent psoralen (CHEBI:27616) methoxsalen (CHEBI:18358) has functional parent psoralen (CHEBI:27616)

IUPAC Name

7H-furo[3,2-g]chromen-7-one

Synonyms	Sources
3-(6-hydroxy-5-benzofuranyl)-2-propenoic acid δ-lactone	NIST Chemistry WebBook
6,7-furanocoumarin	NIST Chemistry WebBook
6-hydroxy-5-benzofuranacrylic acid δ-lactone	NIST Chemistry WebBook
7H-furo[3,2-g][1]benzopyran-7-one	NIST Chemistry WebBook
Ficusin	KEGG COMPOUND
furo[2',3':7,6]coumarin	NIST Chemistry WebBook
furo[4',5':6,7]coumarin	NIST Chemistry WebBook
furocoumarin	ChemIDplus
Psoralen	KEGG COMPOUND
psoralen	UniProt
psoralène	ChEBI

Brand Name	Source
Manaderm	KEGG DRUG

Last Modified

28 July 2014