[(2R,3S,4S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl (2S)-2-azanyl-3-methyl-butanoate; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: [(2R,3S,4S,5R)-5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3,4-bis(oxidanyl)oxolan-2-yl]methyl (2S)-2-azanyl-3-methyl-butanoate; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: [(2R,3S,4S,5R)-5-(4-amino-2-oxo-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl (2S)-2-amino-3-methyl-butanoate; 2,2,2-trifluoroacetic acid CAS Name: (2S)-2-amino-3-methylbutanoic acid [(2R,3S,4S,5R)-5-(4-amino-2-oxo-1-pyrimidinyl)-3,4-dihydroxy-2-oxolanyl]methyl ester; 2,2,2-trifluoroacetic acid IUPAC Name: [(2R,3S,4S,5R)-5-(4-amino-2-oxopyrimidin-1-yl)-3,4-dihydroxyoxolan-2-yl]methyl (2S)-2-amino-3-methylbutanoate; 2,2,2-trifluoroacetic acid Traditional Name: (2S)-2-amino-3-methyl-butyric acid [(2R,3S,4S,5R)-5-(4-amino-2-keto-pyrimidin-1-yl)-3,4-dihydroxy-tetrahydrofuran-2-yl]methyl ester; 2,2,2-trifluoroacetic acid Formula: C16H23F3N4O8 MolecularWeight: 456.37103

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1C(C(C(O1)N2C=CC(=NC2=O)N)O)O)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

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

InChI

InChI=1S/C14H22N4O6.C2HF3O2/c1-6(2)9(16)13(21)23-5-7-10(19)11(20)12(24-7)18-4-3-8(15)17-14(18)22;3-2(4,5)1(6)7/h3-4,6-7,9-12,19-20H,5,16H2,1-2H3,(H2,15,17,22);(H,6,7)/t7-,9+,10-,11+,12-;/m1./s1