Molecule ID: 441106

IUPAC Name: 1,3,4,10,11,12-hexahydroxy-6-methyltetracene-2-carboxamide

Description: The molecule is a member of the class of pretetramides that is 6-methyltetracene-2-carboxamide carrying six hydroxy substituents at positions 1, 3, 4, 10, 11 and 12. It has a role as a bacterial metabolite. It is a conjugate acid of a 4-hydroxy-6-methylpretetramide(1-).

SMILES: Cc1c2cccc(O)c2c(O)c2c(O)c3c(O)c(C(=N)O)c(O)c(O)c3cc12

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][Branch1][C][O][=C][Ring1][N][C][=C][Ring2][Ring1][O][Ring1][P]

InChI: InChI=1S/C20H15NO7/c1-6-7-3-2-4-10(22)11(7)16(24)12-8(6)5-9-13(17(12)25)18(26)14(20(21)28)19(27)15(9)23/h2-5,22-27H,1H3,(H2,21,28)

Molecular Properties:
- Polar Surface Area: 165.0 Ų
- LogP: 4.4