The Biofilms Structural Database
Name
URIDINE-5'-DIPHOSPHATE-2-DEOXY-2-FLUORO-ALPHA-D-GLUCOSE
Molecular Weight
568.29
Isomeric SMILES
OC[C@H]1O[C@H](O[P@](O)(=O)O[P@@](O)(=O)OC[C@H]2O[C@H]([C@H](O)[C@@H]2O)n2ccc(=O)[nH]c2=O)[C@H](F)[C@@H](O)[C@@H]1O
Formula
C15H23FN2O16P2
Identifiers
[[(2R,3S,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-hydroxy-phosphoryl] [(2R,3R,4S,5S,6R)-3-fluoro-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl] hydrogen phosphate
Formal Charge
0
InChI
InChI=1S/C15H23FN2O16P2/c16-8-11(23)9(21)5(3-19)32-14(8)33-36(28,29)34-35(26,27)30-4-6-10(22)12(24)13(31-6)18-2-1-7(20)17-15(18)25/h1-2,5-6,8-14,19,21-24H,3-4H2,(H,26,27)(H,28,29)(H,17,20,25)/t5-,6-,8-,9-,10-,11-,12-,13-,14-/m1/s1
Atom Count
59
InChIKey
NGTCPFGWXMBZEP-NQQHDEILSA-N
PDB codes
5UQK, 5UQM, 5UQN
Type
NON-POLYMER
Chiral Atom Count
11
Chiral Atoms
C1, C1', C2, C2', C3, C3', C4, C4', C5, PA, PB
Bond Count
61
Aromatic Bond Count
Leaving Atoms
n/a