Molecule ID: 8616

IUPAC Name: 3-methoxy-2-propan-2-ylfuro[3,2-g]chromen-7-one

Description: The molecule is a member of the class of furanocoumarins that is furo[3,2-g]chromen-7-one, bearing additional isopropyl and methoxy substituents at positions 2 and 3 respectively. It has a role as a plant metabolite. It is a furanocoumarin, an aromatic ether and a lactone.

SMILES: COc1c(C(C)C)oc2cc3oc(=O)ccc3cc12

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

InChI: InChI=1S/C15H14O4/c1-8(2)14-15(17-3)10-6-9-4-5-13(16)18-11(9)7-12(10)19-14/h4-8H,1-3H3

Molecular Properties:
- Polar Surface Area: 48.7 Ų
- LogP: 3.4