(2R,3R,4S)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolane-3-sulfonate

Systemtic Name: (2R,3R,4S)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-4-oxidanyl-oxolane-3-sulfonate Openeye Name: (2R,3R,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-sulfonate CAS Name: (2R,3R,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)-3-oxolanesulfonate IUPAC Name: (2R,3R,4S)-5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymethyl)oxolane-3-sulfonate Traditional Name: (2R,3R,4S)-5-adenin-9-yl-4-hydroxy-2-methylol-tetrahydrofuran-3-sulfonate Formula: C10H12N5O6S- MolecularWeight: 330.29718

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(O3)CO)S(=O)(=O)[O-])O

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2C3[C@@H]([C@H]([C@H](O3)CO)S(=O)(=O)[O-])O

InChI

InChI=1S/C10H13N5O6S/c11-8-5-9(13-2-12-8)15(3-14-5)10-6(17)7(22(18,19)20)4(1-16)21-10/h2-4,6-7,10,16-17H,1H2,(H2,11,12,13)(H,18,19,20)/p-1/t4-,6-,7+,10?/m1/s1