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

Systemtic Name: [1-[[(2R,3S,4S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methoxy-oxidanyl-phosphoryl]-1-oxidanyl-ethyl]phosphonic acid Openeye Name: [1-[[(2R,3S,4S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]-1-hydroxy-ethyl]phosphonic acid CAS Name: [1-[[(2R,3S,4S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methoxy-hydroxyphosphoryl]-1-hydroxyethyl]phosphonic acid IUPAC Name: [1-[[(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methoxy-hydroxyphosphoryl]-1-hydroxyethyl]phosphonic acid Traditional Name: [1-[[(2R,3S,4S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methoxy-hydroxy-phosphoryl]-1-hydroxy-ethyl]phosphonic acid Formula: C11H19N3O11P2 MolecularWeight: 431.229582

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Descriptors Computed from Structure

Canonical SMILES:

CC(O)(P(=O)(O)O)P(=O)(O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O

Isomeric SMILES

CC(O)(P(=O)(O)O)P(=O)(O)OC[C@@H]1[C@H]([C@@H]([C@@H](O1)N2C=CC(=NC2=O)N)O)O

InChI

InChI=1S/C11H19N3O11P2/c1-11(18,26(19,20)21)27(22,23)24-4-5-7(15)8(16)9(25-5)14-3-2-6(12)13-10(14)17/h2-3,5,7-9,15-16,18H,4H2,1H3,(H,22,23)(H2,12,13,17)(H2,19,20,21)/t5-,7-,8+,9-,11?/m1/s1