Molecule ID: 135563708

IUPAC Name: 6-[(E)-4-hydroxybut-2-en-2-yl]-4-methoxy-3-methylpyran-2-one

Description: The molecule is a member of the class of nectriapyrones that is nectriapyrone that carries a hydroxy group at position 4. It is a fungal metabolite isolated from Diaporthe gulyae. It has a role as a fungal metabolite. It derives from a nectriapyrone.

SMILES: COc1cc(/C(C)=C/CO)oc(=O)c1C

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

InChI: InChI=1S/C11H14O4/c1-7(4-5-12)9-6-10(14-3)8(2)11(13)15-9/h4,6,12H,5H2,1-3H3/b7-4+

Molecular Properties:
- Polar Surface Area: 55.8 Ų
- LogP: 1.2