[(1R,2R,4R)-4-(6-aminopurin-9-yl)-2-phosphonooxy-cyclopentyl]methyl dihydrogen phosphate

Systemtic Name: [(1R,2R,4R)-4-(6-aminopurin-9-yl)-2-phosphonooxy-cyclopentyl]methyl dihydrogen phosphate Openeye Name: [(1R,2R,4R)-4-(6-aminopurin-9-yl)-2-phosphonooxy-cyclopentyl]methyl dihydrogen phosphate CAS Name: [(1R,2R,4R)-4-(6-aminopurin-9-yl)-2-phosphonooxycyclopentyl]methyl dihydrogen phosphate IUPAC Name: [(1R,2R,4R)-4-(6-aminopurin-9-yl)-2-phosphonooxycyclopentyl]methyl dihydrogen phosphate Traditional Name: [(1R,2R,4R)-4-adenin-9-yl-2-phosphonooxy-cyclopentyl]methyl dihydrogen phosphate Formula: C11H17N5O8P2 MolecularWeight: 409.228902

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(C1COP(=O)(O)O)OP(=O)(O)O)N2C=NC3=C2N=CN=C3N

Isomeric SMILES

C1[C@H](C[C@H]([C@H]1COP(=O)(O)O)OP(=O)(O)O)N2C=NC3=C2N=CN=C3N

InChI

InChI=1S/C11H17N5O8P2/c12-10-9-11(14-4-13-10)16(5-15-9)7-1-6(3-23-25(17,18)19)8(2-7)24-26(20,21)22/h4-8H,1-3H2,(H2,12,13,14)(H2,17,18,19)(H2,20,21,22)/t6-,7-,8-/m1/s1