Molecule ID: 145864723

IUPAC Name: 4,6-dihydroxy-2-methyl-8-oxobenzo[g]chromen-5-olate

Description: The molecule is a phenolate anion obtained by deprotonation of the 5-hydroxy group of norrubrofusarin. It is the major microspecies at pH 7.3. It is a conjugate base of a norrubrofusarin.

SMILES: Cc1cc([O-])c2c(O)c3c(O)cc(=O)cc3cc2o1

SELFIES: [C][C][=C][C][Branch1][C][O-1][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][C][=Branch1][C][=O][C][=C][Ring1][Branch2][C][=C][Ring1][=N][O][Ring2][Ring1][C]

InChI: InChI=1S/C14H10O5/c1-6-2-9(16)13-11(19-6)4-7-3-8(15)5-10(17)12(7)14(13)18/h2-5,16-18H,1H3/p-1

Molecular Properties:
- Polar Surface Area: 89.8 Ų
- LogP: 1.0