2-[(2S,5R)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]ethylphosphonic acid

Systemtic Name: 2-[(2S,5R)-5-(6-oxidanylidene-3H-purin-9-yl)oxolan-2-yl]ethylphosphonic acid Openeye Name: 2-[(2S,5R)-5-(6-oxo-3H-purin-9-yl)tetrahydrofuran-2-yl]ethylphosphonic acid CAS Name: 2-[(2S,5R)-5-(6-oxo-3H-purin-9-yl)-2-oxolanyl]ethylphosphonic acid IUPAC Name: 2-[(2S,5R)-5-(6-oxo-3H-purin-9-yl)oxolan-2-yl]ethylphosphonic acid Traditional Name: 2-[(2S,5R)-5-(6-keto-3H-purin-9-yl)tetrahydrofuran-2-yl]ethylphosphonic acid Formula: C11H15N4O5P MolecularWeight: 314.234361

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1CCP(=O)(O)O)N2C=NC3=C2NC=NC3=O

Isomeric SMILES

C1C[C@@H](O[C@@H]1CCP(=O)(O)O)N2C=NC3=C2NC=NC3=O

InChI

InChI=1S/C11H15N4O5P/c16-11-9-10(12-5-13-11)15(6-14-9)8-2-1-7(20-8)3-4-21(17,18)19/h5-8H,1-4H2,(H,12,13,16)(H2,17,18,19)/t7-,8+/m0/s1