(1S,2S,3S,6R)-6-(6-aminopurin-9-yl)cyclohex-4-ene-1,2,3-triol

Systemtic Name: (1S,2S,3S,6R)-6-(6-aminopurin-9-yl)cyclohex-4-ene-1,2,3-triol Openeye Name: (1S,2S,3S,6R)-6-(6-aminopurin-9-yl)cyclohex-4-ene-1,2,3-triol CAS Name: (1S,2S,3S,6R)-6-(6-aminopurin-9-yl)cyclohex-4-ene-1,2,3-triol IUPAC Name: (1S,2S,3S,6R)-6-(6-aminopurin-9-yl)cyclohex-4-ene-1,2,3-triol Traditional Name: (1S,2S,3S,6R)-6-adenin-9-ylcyclohex-4-ene-1,2,3-triol Formula: C11H13N5O3 MolecularWeight: 263.25262

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(C(C(C1N2C=NC3=C2N=CN=C3N)O)O)O

Isomeric SMILES

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

InChI

InChI=1S/C11H13N5O3/c12-10-7-11(14-3-13-10)16(4-15-7)5-1-2-6(17)9(19)8(5)18/h1-6,8-9,17-19H,(H2,12,13,14)/t5-,6+,8+,9+/m1/s1