Molecule ID: 6993205

IUPAC Name: [(2S,5R)-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl phosphate

Description: The molecule is a 2',3'-dideoxyribonucleoside monophosphate oxoanion obtained from 2',3'-dideoxythymidine phosphate by deprotonation of the phosphate OH groups; major species at pH 7.3

SMILES: Cc1cn([C@H]2CC[C@@H](COP(=O)([O-])O)O2)c(=O)nc1[O-]

SELFIES: [C][C][=C][N][Branch2][Ring1][Ring2][C@H1][C][C][C@@H1][Branch1][O][C][O][P][=Branch1][C][=O][Branch1][C][O-1][O][O][Ring1][O][C][=Branch1][C][=O][N][=C][Ring2][Ring1][C][O-1]

InChI: InChI=1S/C10H15N2O7P/c1-6-4-12(10(14)11-9(6)13)8-3-2-7(19-8)5-18-20(15,16)17/h4,7-8H,2-3,5H2,1H3,(H,11,13,14)(H2,15,16,17)/p-2/t7-,8+/m0/s1

Molecular Properties:
- Polar Surface Area: 131.0 Ų
- LogP: -2.9