[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl [(2S,3S,4R,5R)-3-azanyl-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4-oxidanyl-oxolan-2-yl]methyl hydrogen phosphate

Systemtic Name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl [(2S,3S,4R,5R)-3-azanyl-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-4-oxidanyl-oxolan-2-yl]methyl hydrogen phosphate Openeye Name: [(2S,3S,4R,5R)-3-amino-5-(4-amino-2-oxo-pyrimidin-1-yl)-4-hydroxy-tetrahydrofuran-2-yl]methyl [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate CAS Name: [(2S,3S,4R,5R)-3-amino-5-(4-amino-2-oxo-1-pyrimidinyl)-4-hydroxy-2-oxolanyl]methyl [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methyl hydrogen phosphate IUPAC Name: [(2S,3S,4R,5R)-3-amino-5-(4-amino-2-oxopyrimidin-1-yl)-4-hydroxyoxolan-2-yl]methyl [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methyl hydrogen phosphate Traditional Name: [(2R,3S,4R,5R)-5-adenin-9-yl-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl [(2S,3S,4R,5R)-3-amino-5-(4-amino-2-keto-pyrimidin-1-yl)-4-hydroxy-tetrahydrofuran-2-yl]methyl hydrogen phosphate Formula: C19H26N9O10P MolecularWeight: 571.437801

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=O)N=C1N)C2C(C(C(O2)COP(=O)(O)OCC3C(C(C(O3)N4C=NC5=C4N=CN=C5N)O)O)N)O

Isomeric SMILES

C1=CN(C(=O)N=C1N)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)N4C=NC5=C4N=CN=C5N)O)O)N)O

InChI

InChI=1S/C19H26N9O10P/c20-9-1-2-27(19(32)26-9)17-13(30)10(21)7(37-17)3-35-39(33,34)36-4-8-12(29)14(31)18(38-8)28-6-25-11-15(22)23-5-24-16(11)28/h1-2,5-8,10,12-14,17-18,29-31H,3-4,21H2,(H,33,34)(H2,20,26,32)(H2,22,23,24)/t7-,8-,10-,12-,13-,14-,17-,18-/m1/s1