1-[5-[[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-[3-(dimethylamino)propylamino]phosphoryl]oxymethyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione

Systemtic Name: 1-[5-[[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-[3-(dimethylamino)propylamino]phosphoryl]oxymethyl]-4-oxidanyl-oxolan-2-yl]-5-methyl-pyrimidine-2,4-dione Openeye Name: 1-[5-[[[5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl]oxy-[3-(dimethylamino)propylamino]phosphoryl]oxymethyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione CAS Name: 1-[5-[[[5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)-3-oxolanyl]oxy-[3-(dimethylamino)propylamino]phosphoryl]oxymethyl]-4-hydroxy-2-oxolanyl]-5-methylpyrimidine-2,4-dione IUPAC Name: 1-[5-[[[5-(2-amino-6-oxo-3H-purin-9-yl)-2-(hydroxymethyl)oxolan-3-yl]oxy-[3-(dimethylamino)propylamino]phosphoryl]oxymethyl]-4-hydroxyoxolan-2-yl]-5-methylpyrimidine-2,4-dione Traditional Name: 1-[5-[[[5-(2-amino-6-keto-3H-purin-9-yl)-2-methylol-tetrahydrofuran-3-yl]oxy-[3-(dimethylamino)propylamino]phosphoryl]oxymethyl]-4-hydroxy-tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-quinone Formula: C25H38N9O10P MolecularWeight: 655.597281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(NCCCN(C)C)OC3CC(OC3CO)N4C=NC5=C4NC(=NC5=O)N)O

Isomeric SMILES

CC1=CN(C(=O)NC1=O)C2CC(C(O2)COP(=O)(NCCCN(C)C)OC3CC(OC3CO)N4C=NC5=C4NC(=NC5=O)N)O

InChI

InChI=1S/C25H38N9O10P/c1-13-9-33(25(39)31-22(13)37)18-7-14(36)17(43-18)11-41-45(40,28-5-4-6-32(2)3)44-15-8-19(42-16(15)10-35)34-12-27-20-21(34)29-24(26)30-23(20)38/h9,12,14-19,35-36H,4-8,10-11H2,1-3H3,(H,28,40)(H,31,37,39)(H3,26,29,30,38)