(3S,5S)-5-(6-azanylpurin-1-yl)-5-(diethoxyphosphorylmethoxy)oxolan-3-ol

Systemtic Name: (3S,5S)-5-(6-azanylpurin-1-yl)-5-(diethoxyphosphorylmethoxy)oxolan-3-ol Openeye Name: (3S,5S)-5-(6-aminopurin-1-yl)-5-(diethoxyphosphorylmethoxy)tetrahydrofuran-3-ol CAS Name: (3S,5S)-5-(6-amino-1-purinyl)-5-(diethoxyphosphorylmethoxy)-3-oxolanol IUPAC Name: (3S,5S)-5-(6-aminopurin-1-yl)-5-(diethoxyphosphorylmethoxy)oxolan-3-ol Traditional Name: (3S,5S)-5-(6-aminopurin-1-yl)-5-(diethoxyphosphorylmethoxy)tetrahydrofuran-3-ol Formula: C14H22N5O6P MolecularWeight: 387.328141

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(COC1(CC(CO1)O)N2C=NC3=NC=NC3=C2N)OCC

Isomeric SMILES

CCOP(=O)(CO[C@@]1(C[C@@H](CO1)O)N2C=NC3=NC=NC3=C2N)OCC

InChI

InChI=1S/C14H22N5O6P/c1-3-24-26(21,25-4-2)9-23-14(5-10(20)6-22-14)19-8-18-13-11(12(19)15)16-7-17-13/h7-8,10,20H,3-6,9,15H2,1-2H3/t10-,14-/m0/s1