4-[[(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(2R,3S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]methoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[(2R,3S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy]-4-oxo-butanoic acid CAS Name: 4-[[(2R,3S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]methoxy]-4-oxobutanoic acid IUPAC Name: 4-[[(2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]methoxy]-4-oxobutanoic acid Traditional Name: 4-[[(2R,3S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]methoxy]-4-keto-butyric acid Formula: C13H17N3O7 MolecularWeight: 327.28998

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)COC(=O)CCC(=O)O)O

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1N2C=CC(=NC2=O)N)COC(=O)CCC(=O)O)O

InChI

InChI=1S/C13H17N3O7/c14-9-3-4-16(13(21)15-9)10-5-7(17)8(23-10)6-22-12(20)2-1-11(18)19/h3-4,7-8,10,17H,1-2,5-6H2,(H,18,19)(H2,14,15,21)/t7-,8+,10+/m0/s1