Glycoside
GD039211
Name:
2'-fluoroguanylyl-(3'-5')-phosphocytidineFormula:
C19H24O11N8FPSmiles:
Nc1ccn([C@H]2O[C@H](CO[P@@](=O)(O)O[C@@H]3[C@H](F)[C@@H](n4cnc5c(=O)[nH]c(N)nc54)O[C@@H]3CO)[C@@H](O)[C@H]2O)c(=O)n1Aglycone:
COP(=O)(O)OC1C(CO)OC(n2cnc3c(=O)[nH]c(N)nc32)C1F.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 19 | RingCount: | 5 |
| HBD: | 9 | FractionCSP3: | 0.53 |
| AlogP: | -3.11 | Num_rotatable_bonds: | 8 |
| MolWt: | 590.42 | Num_heavy_atoms: | 40 |
| TPSA: | 285.41 | NumAromaticRings: | 3 |
Unique Aglycone
AD00115
Formula: C4H5ON3
Smiles:
Nc1cc[nH]c(=O)n1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 0 |
| MolWt: | 111.1 | Num_heavy_atoms: | 8 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
AD24310
Formula: C11H15O7N5FP
Smiles:
COP(=O)(O)OC1C(CO)OC(n2cnc3c(=O)[nH]c(N)nc32)C1F| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -0.94 | Num_rotatable_bonds: | 5 |
| MolWt: | 379.24 | Num_heavy_atoms: | 25 |
| TPSA: | 174.81 | NumAromaticRings: | 2 |
