sodium 9-[(4aR,6R,7R,7aR)-7-(2-methoxyethoxy)-2-oxidanidyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-azanyl-3H-purin-6-one

Systemtic Name: sodium 9-[(4aR,6R,7R,7aR)-7-(2-methoxyethoxy)-2-oxidanidyl-2-oxidanylidene-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-azanyl-3H-purin-6-one Openeye Name: sodium 9-[(4aR,6R,7R,7aR)-7-(2-methoxyethoxy)-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one CAS Name: sodium 9-[(4aR,6R,7R,7aR)-7-(2-methoxyethoxy)-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-2-amino-3H-purin-6-one IUPAC Name: sodium 9-[(4aR,6R,7R,7aR)-7-(2-methoxyethoxy)-2-oxido-2-oxo-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphinin-6-yl]-2-amino-3H-purin-6-one Traditional Name: sodium 9-[(4aR,6R,7R,7aR)-2-keto-7-(2-methoxyethoxy)-2-oxido-4a,6,7,7a-tetrahydro-4H-furo[3,2-d][1,3,2]dioxaphosphorin-6-yl]-2-amino-3H-purin-6-one Formula: C13H17N5NaO8P MolecularWeight: 425.266311

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1C2C(COP(=O)(O2)[O-])OC1N3C=NC4=C3NC(=NC4=O)N.[Na+]

Isomeric SMILES

COCCO[C@@H]1[C@H]2[C@@H](COP(=O)(O2)[O-])O[C@H]1N3C=NC4=C3NC(=NC4=O)N.[Na+]

InChI

InChI=1S/C13H18N5O8P.Na/c1-22-2-3-23-9-8-6(4-24-27(20,21)26-8)25-12(9)18-5-15-7-10(18)16-13(14)17-11(7)19;/h5-6,8-9,12H,2-4H2,1H3,(H,20,21)(H3,14,16,17,19);/q;+1/p-1/t6-,8-,9-,12-;/m1./s1