Molecule ID: 250817

IUPAC Name: (3-acetyloxy-6-oxo-[1]benzofuro[3,2-c]chromen-9-yl) acetate

Description: The molecule is a member of the class of coumestans that is the diacetate ester derivative of coumestrol. It is a member of coumestans, a delta-lactone and an acetate ester. It derives from a coumestrol.

SMILES: CC(=O)Oc1ccc2c(c1)oc(=O)c1c3ccc(OC(C)=O)cc3oc21

SELFIES: [C][C][=Branch1][C][=O][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][=Branch1][C][=O][C][C][=C][C][=C][Branch1][#Branch1][O][C][Branch1][C][C][=O][C][=C][Ring1][#Branch2][O][C][Ring2][Ring1][Ring1][=Ring1][=N]

InChI: InChI=1S/C19H12O7/c1-9(20)23-11-3-5-13-15(7-11)25-18-14-6-4-12(24-10(2)21)8-16(14)26-19(22)17(13)18/h3-8H,1-2H3

Molecular Properties:
- Polar Surface Area: 92.0 Ų
- LogP: 3.0