[(5R)-5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate hydrate

Systemtic Name: [(5R)-5-(6-aminopurin-9-yl)-3-oxidanyl-oxolan-2-yl]methyl dihydrogen phosphate hydrate Openeye Name: [(5R)-5-(6-aminopurin-9-yl)-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate hydrate CAS Name: [(5R)-5-(6-aminopurin-9-yl)-3-hydroxy-2-oxolanyl]methyl dihydrogen phosphate hydrate IUPAC Name: [(5R)-5-(6-aminopurin-9-yl)-3-hydroxyoxolan-2-yl]methyl dihydrogen phosphate hydrate Traditional Name: [(5R)-5-adenin-9-yl-3-hydroxy-tetrahydrofuran-2-yl]methyl dihydrogen phosphate hydrate Formula: C10H16N5O7P MolecularWeight: 349.237101

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)COP(=O)(O)O)O.O

Isomeric SMILES

C1[C@@H](OC(C1O)COP(=O)(O)O)N2C=NC3=C2N=CN=C3N.O

InChI

InChI=1S/C10H14N5O6P.H2O/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(21-7)2-20-22(17,18)19;/h3-7,16H,1-2H2,(H2,11,12,13)(H2,17,18,19);1H2/t5?,6?,7-;/m1./s1