Molecule ID: 91825627

IUPAC Name: 4-hydroxy-6-(3-methyl-2-oxoheptadecyl)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 3-methyl-2-oxoheptadecyl group.

SMILES: CCCCCCCCCCCCCCC(C)C(=O)Cc1cc(O)cc(=O)o1

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

InChI: InChI=1S/C23H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19(2)22(25)18-21-16-20(24)17-23(26)27-21/h16-17,19,24H,3-15,18H2,1-2H3

Molecular Properties:
- Polar Surface Area: 63.6 Ų
- LogP: 7.7