6-oxidanyl-5-[1,2,2-tris(2-methyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)ethyl]-1H-pyrimidine-2,4-dione

Systemtic Name: 6-oxidanyl-5-[1,2,2-tris(2-methyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-5-yl)ethyl]-1H-pyrimidine-2,4-dione Openeye Name: 6-hydroxy-5-[1,2,2-tris(4-hydroxy-2-methyl-6-oxo-1H-pyrimidin-5-yl)ethyl]-1H-pyrimidine-2,4-dione CAS Name: 6-hydroxy-5-[1,2,2-tris(4-hydroxy-2-methyl-6-oxo-1H-pyrimidin-5-yl)ethyl]-1H-pyrimidine-2,4-dione IUPAC Name: 6-hydroxy-5-[1,2,2-tris(4-hydroxy-2-methyl-6-oxo-1H-pyrimidin-5-yl)ethyl]-1H-pyrimidine-2,4-dione Traditional Name: 6-hydroxy-5-[1,2,2-tris(4-hydroxy-6-keto-2-methyl-1H-pyrimidin-5-yl)ethyl]uracil Formula: C21H20N8O9 MolecularWeight: 528.4317

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(=O)N1)C(C2=C(NC(=O)NC2=O)O)C(C3=C(N=C(NC3=O)C)O)C4=C(N=C(NC4=O)C)O)O

Isomeric SMILES

CC1=NC(=C(C(=O)N1)C(C2=C(NC(=O)NC2=O)O)C(C3=C(N=C(NC3=O)C)O)C4=C(N=C(NC4=O)C)O)O

InChI

InChI=1S/C21H20N8O9/c1-4-22-13(30)9(14(31)23-4)7(10-15(32)24-5(2)25-16(10)33)8(11-17(34)26-6(3)27-18(11)35)12-19(36)28-21(38)29-20(12)37/h7-8H,1-3H3,(H2,22,23,30,31)(H2,24,25,32,33)(H2,26,27,34,35)(H3,28,29,36,37,38)