[2-[5-(6-aminopurin-9-yl)-2-(azidooxymethyl)-4-oxidanyl-oxolan-3-yl]oxycarbonylimidazolidin-4-yl]phosphonic acid

Systemtic Name: [2-[5-(6-aminopurin-9-yl)-2-(azidooxymethyl)-4-oxidanyl-oxolan-3-yl]oxycarbonylimidazolidin-4-yl]phosphonic acid Openeye Name: [2-[5-(6-aminopurin-9-yl)-2-(azidooxymethyl)-4-hydroxy-tetrahydrofuran-3-yl]oxycarbonylimidazolidin-4-yl]phosphonic acid CAS Name: [2-[[5-(6-aminopurin-9-yl)-2-(azidooxymethyl)-4-hydroxy-3-oxolanyl]oxy-oxomethyl]-4-imidazolidinyl]phosphonic acid IUPAC Name: [2-[5-(6-aminopurin-9-yl)-2-(azidooxymethyl)-4-hydroxyoxolan-3-yl]oxycarbonylimidazolidin-4-yl]phosphonic acid Traditional Name: [2-[5-adenin-9-yl-2-(azidooxymethyl)-4-hydroxy-tetrahydrofuran-3-yl]oxycarbonylimidazolidin-4-yl]phosphonic acid Formula: C14H19N10O8P MolecularWeight: 486.336621

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Descriptors Computed from Structure

Canonical SMILES:

C1C(NC(N1)C(=O)OC2C(OC(C2O)N3C=NC4=C3N=CN=C4N)CON=[N+]=[N-])P(=O)(O)O

Isomeric SMILES

C1C(NC(N1)C(=O)OC2C(OC(C2O)N3C=NC4=C3N=CN=C4N)CON=[N+]=[N-])P(=O)(O)O

InChI

InChI=1S/C14H19N10O8P/c15-10-7-12(19-3-18-10)24(4-20-7)13-8(25)9(5(31-13)2-30-23-22-16)32-14(26)11-17-1-6(21-11)33(27,28)29/h3-6,8-9,11,13,17,21,25H,1-2H2,(H2,15,18,19)(H2,27,28,29)