(2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolane-3-carboxylic acid

Systemtic Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolane-3-carboxylic acid Openeye Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)tetrahydrofuran-3-carboxylic acid CAS Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)-3-oxolanecarboxylic acid IUPAC Name: (2S,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolane-3-carboxylic acid Traditional Name: (2S,3S,5R)-5-adenin-9-yl-2-methylol-tetrahydrofuran-3-carboxylic acid Formula: C11H13N5O4 MolecularWeight: 279.25202

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=NC3=C2N=CN=C3N)CO)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5O4/c12-9-8-10(14-3-13-9)16(4-15-8)7-1-5(11(18)19)6(2-17)20-7/h3-7,17H,1-2H2,(H,18,19)(H2,12,13,14)/t5-,6+,7+/m0/s1