[(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-[(3R)-3-oxidanylidene-3-phosphonooxy-1,2,3$l^{5}-dioxaphosphiran-1-ium-1-yl]phosphinic acid

Systemtic Name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-[(3R)-3-oxidanylidene-3-phosphonooxy-1,2,3$l^{5}-dioxaphosphiran-1-ium-1-yl]phosphinic acid Openeye Name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-[(3R)-3-oxo-3-phosphonooxy-1,2,3$l^{5}-dioxaphosphiran-1-ium-1-yl]phosphinic acid CAS Name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-2-oxolanyl]methoxy-[(3R)-3-oxo-3-phosphonooxy-1,2,3$l^{5}-dioxaphosphiran-1-ium-1-yl]phosphinic acid IUPAC Name: [(2R,3S,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-[(3R)-3-oxo-3-phosphonooxy-1,2,3$l^{5}-dioxaphosphiran-1-ium-1-yl]phosphinic acid Traditional Name: [(2R,3S,4R,5R)-5-adenin-9-yl-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-[(3R)-3-keto-3-phosphonooxy-1,2,3$l^{5}-dioxaphosphiran-1-ium-1-yl]phosphinic acid Formula: C10H15N5O13P3+ MolecularWeight: 506.173083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)COP(=O)(O)[O+]4OP4(=O)OP(=O)(O)O)O)O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)[O+]4O[P@]4(=O)OP(=O)(O)O)O)O

InChI

InChI=1S/C10H14N5O13P3/c11-8-5-9(13-2-12-8)15(3-14-5)10-7(17)6(16)4(25-10)1-24-30(21,22)28-26-31(28,23)27-29(18,19)20/h2-4,6-7,10,16-17H,1H2,(H4-,11,12,13,18,19,20,21,22)/p+1/t4-,6-,7-,10-,31-/m1/s1