8-(imidazol-1-ylmethyl)-7-methyl-10-[2,3,4,5-tetrakis(oxidanyl)pentyl]benzo[g]pteridine-2,4-dione

Systemtic Name: 8-(imidazol-1-ylmethyl)-7-methyl-10-[2,3,4,5-tetrakis(oxidanyl)pentyl]benzo[g]pteridine-2,4-dione Openeye Name: 8-(imidazol-1-ylmethyl)-7-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione CAS Name: 8-(1-imidazolylmethyl)-7-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione IUPAC Name: 8-(imidazol-1-ylmethyl)-7-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-dione Traditional Name: 8-(imidazol-1-ylmethyl)-7-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridine-2,4-quinone Formula: C20H22N6O6 MolecularWeight: 442.42528

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1CN3C=CN=C3)N(C4=NC(=O)NC(=O)C4=N2)CC(C(C(CO)O)O)O

Isomeric SMILES

CC1=CC2=C(C=C1CN3C=CN=C3)N(C4=NC(=O)NC(=O)C4=N2)CC(C(C(CO)O)O)O

InChI

InChI=1S/C20H22N6O6/c1-10-4-12-13(5-11(10)6-25-3-2-21-9-25)26(7-14(28)17(30)15(29)8-27)18-16(22-12)19(31)24-20(32)23-18/h2-5,9,14-15,17,27-30H,6-8H2,1H3,(H,24,31,32)