Molecule ID: 16196968

IUPAC Name: 2-(2,3-dihydroxy-5-methylphenoxy)-5-methylbenzene-1,3-diol

Description: The molecule is an aromatic ether in which the ether functionality links a 2,3-dihydroxy-5-methylphenyl group with a 2,6-dihydroxy-4-methylphenyl group. Fungal metabolite isolated inter alia from Aspergillus spp. It has a role as a mycotoxin. It is a member of resorcinols, an aromatic ether and a member of catechols.

SMILES: Cc1cc(O)c(Oc2cc(C)cc(O)c2O)c(O)c1

SELFIES: [C][C][=C][C][Branch1][C][O][=C][Branch1][P][O][C][=C][C][Branch1][C][C][=C][C][Branch1][C][O][=C][Ring1][Branch2][O][C][Branch1][C][O][=C][Ring2][Ring1][C]

InChI: InChI=1S/C14H14O5/c1-7-4-10(16)14(11(17)5-7)19-12-6-8(2)3-9(15)13(12)18/h3-6,15-18H,1-2H3

Molecular Properties:
- Polar Surface Area: 90.2 Ų
- LogP: 2.8