(1S,2R,3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-bis(hydroxymethyl)cyclopentane-1,2-diol

Systemtic Name: (1S,2R,3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-bis(hydroxymethyl)cyclopentane-1,2-diol Openeye Name: (1S,2R,3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-bis(hydroxymethyl)cyclopentane-1,2-diol CAS Name: (1S,2R,3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-bis(hydroxymethyl)cyclopentane-1,2-diol IUPAC Name: (1S,2R,3R,4S,5R)-3-(6-aminopurin-9-yl)-4,5-bis(hydroxymethyl)cyclopentane-1,2-diol Traditional Name: (1S,2R,3R,4S,5R)-3-adenin-9-yl-4,5-dimethylol-cyclopentane-1,2-diol Formula: C12H17N5O4 MolecularWeight: 295.29448

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC2=C(C(=N1)N)N=CN2C3C(C(C(C3O)O)CO)CO

Isomeric SMILES

C1=NC2=C(C(=N1)N)N=CN2[C@@H]3[C@H]([C@@H]([C@@H]([C@@H]3O)O)CO)CO

InChI

InChI=1S/C12H17N5O4/c13-11-7-12(15-3-14-11)17(4-16-7)8-5(1-18)6(2-19)9(20)10(8)21/h3-6,8-10,18-21H,1-2H2,(H2,13,14,15)/t5-,6-,8+,9-,10+/m0/s1