Bergapten

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Bergapten
Bergapten.png
Bergapten (5-methoxypsoralen) - 3D - Ball-and-stick Model.png
Systematic (IUPAC) name
4-methoxy-7H-furo[3,2-g]chromen-7-one
Clinical data
Routes of
administration
Oral
Identifiers
CAS Number 484-20-8 YesY
ATC code D05BA03 (WHO)
PubChem CID: 2355
ChemSpider 2265 YesY
UNII 4FVK84C92X YesY
KEGG D07521 YesY
ChEBI CHEBI:18293 N
ChEMBL CHEMBL24171 YesY
Chemical data
Formula C12H8O4
Molecular mass 216.19 g/mol
  • O=C\1Oc3c(/C=C/1)c(OC)c2ccoc2c3
  • InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3 YesY
  • Key:BGEBZHIAGXMEMV-UHFFFAOYSA-N YesY
 NYesY (what is this?)  (verify)

Bergapten (5-methoxypsoralen) is a psoralen (also known as furocoumarins) found in bergamot essential oil, in other citrus essential oils,[1] and in grapefruit juice.[2] It is the chemical in bergamot oil that causes phototoxicity.[3] Bergapten-free bergamot essential oil or synthetics are now used in perfumery.

References

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