Molecule ID: 441107

IUPAC Name: 1,3,10,11,12-pentahydroxy-6-methyltetracene-2-carboxamide

Description: The molecule is a member of the class of pretetramides in which the only additional substituent is a methyl group at position 6. It has a role as a bacterial metabolite. It derives from a Pretetramid. It is a conjugate acid of a 6-methylpretetramide(1-).

SMILES: Cc1c2cccc(O)c2c(O)c2c(O)c3c(O)c(C(=N)O)c(O)cc3cc12

SELFIES: [C][C][=C][C][=C][C][=C][Branch1][C][O][C][Ring1][#Branch1][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][Branch1][=Branch1][C][=Branch1][C][=N][O][=C][Branch1][C][O][C][=C][Ring1][O][C][=C][Ring2][Ring1][#Branch2][Ring1][S]

InChI: InChI=1S/C20H15NO6/c1-7-9-3-2-4-11(22)14(9)19(26)15-10(7)5-8-6-12(23)16(20(21)27)18(25)13(8)17(15)24/h2-6,22-26H,1H3,(H2,21,27)

Molecular Properties:
- Polar Surface Area: 144.0 Ų
- LogP: 4.8