2-[(2S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]propanoic acid

Systemtic Name: 2-[(2S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]propanoic acid Openeye Name: 2-[(2S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-2-(hydroxymethyl)tetrahydrofuran-3-yl]propanoic acid CAS Name: 2-[(2S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-2-(hydroxymethyl)-3-oxolanyl]propanoic acid IUPAC Name: 2-[(2S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-2-(hydroxymethyl)oxolan-3-yl]propanoic acid Traditional Name: 2-[(2S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-2-methylol-tetrahydrofuran-3-yl]propionic acid Formula: C12H17N3O5 MolecularWeight: 283.28048

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC(OC1CO)N2C=CC(=NC2=O)N)C(=O)O

Isomeric SMILES

CC(C1C[C@@H](O[C@@H]1CO)N2C=CC(=NC2=O)N)C(=O)O

InChI

InChI=1S/C12H17N3O5/c1-6(11(17)18)7-4-10(20-8(7)5-16)15-3-2-9(13)14-12(15)19/h2-3,6-8,10,16H,4-5H2,1H3,(H,17,18)(H2,13,14,19)/t6?,7?,8-,10-/m1/s1