ISOBERGAPTEN

Structure

2D structure of ISOBERGAPTEN
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 68082

Names and identifiers

Name

ISOBERGAPTEN

IUPAC name

5-methoxy-2H-furo[2,3-h]chromen-2-one

SMILES

COC1=C2C=CC(=O)OC2=C3C=COC3=C1

General information

Molecular formula

C12H8O4

Molecular weight

216.19 g/mol

Monoisotopic mass

216.0423 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Pastinaca sativa L. subsp. sativa - -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.