Molecule ID: 91825630

IUPAC Name: 4-hydroxy-6-(13-methyl-2-oxotetradecyl)pyran-2-one

Description: The molecule is an acyl tetraketide pyran-2-one that is 4-hydroxy-2H-pyran-2-one in which the hydrogen at position 6 is replaced by a 13-methyl-2-oxotetradecyl group.

SMILES: CC(C)CCCCCCCCCCC(=O)Cc1cc(O)cc(=O)o1

SELFIES: [C][C][Branch1][C][C][C][C][C][C][C][C][C][C][C][C][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][O][=C][C][=Branch1][C][=O][O][Ring1][Branch2]

InChI: InChI=1S/C20H32O4/c1-16(2)11-9-7-5-3-4-6-8-10-12-17(21)13-19-14-18(22)15-20(23)24-19/h14-16,22H,3-13H2,1-2H3

Molecular Properties:
- Polar Surface Area: 63.6 Ų
- LogP: 5.7