[[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-oxidanyl-3-propanoyloxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]amino]phosphonic acid

Systemtic Name: [[[5-(2-azanyl-6-oxidanylidene-3H-purin-9-yl)-4-oxidanyl-3-propanoyloxy-oxolan-2-yl]methoxy-oxidanyl-phosphoryl]amino]phosphonic acid Openeye Name: [[[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-3-propanoyloxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]amino]phosphonic acid CAS Name: [[[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-3-(1-oxopropoxy)-2-oxolanyl]methoxy-hydroxyphosphoryl]amino]phosphonic acid IUPAC Name: [[[5-(2-amino-6-oxo-3H-purin-9-yl)-4-hydroxy-3-propanoyloxyoxolan-2-yl]methoxy-hydroxyphosphoryl]amino]phosphonic acid Traditional Name: [[[5-(2-amino-6-keto-3H-purin-9-yl)-4-hydroxy-3-propionyloxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]amino]phosphonic acid Formula: C13H20N6O11P2 MolecularWeight: 498.279022

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1C(OC(C1O)N2C=NC3=C2NC(=NC3=O)N)COP(=O)(NP(=O)(O)O)O

Isomeric SMILES

CCC(=O)OC1C(OC(C1O)N2C=NC3=C2NC(=NC3=O)N)COP(=O)(NP(=O)(O)O)O

InChI

InChI=1S/C13H20N6O11P2/c1-2-6(20)30-9-5(3-28-32(26,27)18-31(23,24)25)29-12(8(9)21)19-4-15-7-10(19)16-13(14)17-11(7)22/h4-5,8-9,12,21H,2-3H2,1H3,(H3,14,16,17,22)(H4,18,23,24,25,26,27)