2-azanyl-3-[1-[[7-methyl-2,4-bis(oxidanylidene)-10-[2,3,4,5-tetrakis(oxidanyl)pentyl]benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[1-[[7-methyl-2,4-bis(oxidanylidene)-10-[2,3,4,5-tetrakis(oxidanyl)pentyl]benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid Openeye Name: 2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid CAS Name: 2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)-8-benzo[g]pteridinyl]methyl]-4-imidazolyl]propanoic acid IUPAC Name: 2-amino-3-[1-[[7-methyl-2,4-dioxo-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propanoic acid Traditional Name: 2-amino-3-[1-[[2,4-diketo-7-methyl-10-(2,3,4,5-tetrahydroxypentyl)benzo[g]pteridin-8-yl]methyl]imidazol-4-yl]propionic acid Formula: C23H27N7O8 MolecularWeight: 529.50258

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N7O8/c1-10-2-14-15(3-11(10)5-29-6-12(25-9-29)4-13(24)22(36)37)30(7-16(32)19(34)17(33)8-31)20-18(26-14)21(35)28-23(38)27-20/h2-3,6,9,13,16-17,19,31-34H,4-5,7-8,24H2,1H3,(H,36,37)(H,28,35,38)