Molecule ID: 5320318

IUPAC Name: 7-hydroxy-8-(3-methylbut-2-enyl)chromen-2-one

Description: The molecule is a hydroxycoumarin that is umbelliferone in which the hydrogen at position 8 has been replaced by a prenyl group. It has a role as a plant metabolite and an antifungal agent. It derives from an umbelliferone.

SMILES: CC(C)=CCc1c(O)ccc2ccc(=O)oc12

SELFIES: [C][C][Branch1][C][C][=C][C][C][=C][Branch1][C][O][C][=C][C][C][=C][C][=Branch1][C][=O][O][C][Ring1][N][=Ring1][#Branch1]

InChI: InChI=1S/C14H14O3/c1-9(2)3-6-11-12(15)7-4-10-5-8-13(16)17-14(10)11/h3-5,7-8,15H,6H2,1-2H3

Molecular Properties:
- Polar Surface Area: 46.5 Ų
- LogP: 3.5