Glycoside
GD039103
Name:
5'-o-(n-(l-seryl)-sulfamoyl)cytidineFormula:
C12H19O9N5SSmiles:
Nc1ccn([C@H]2O[C@H](COS(=O)(=O)NC(=O)[C@@H](N)CO)[C@H](O)[C@@H]2O)c(=O)n1Aglycone:
COS(=O)(=O)NC(=O)C(N)CO.Nc1cc[nH]c(=O)n1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.58 |
| AlogP: | -4.86 | Num_rotatable_bonds: | 7 |
| MolWt: | 409.38 | Num_heavy_atoms: | 27 |
| TPSA: | 229.32 | NumAromaticRings: | 1 |
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 |
AD05797
Formula: C4H10O5N2S
Smiles:
COS(=O)(=O)NC(=O)C(N)CO| HBA: | 7 | RingCount: | 0 |
| HBD: | 4 | FractionCSP3: | 0.75 |
| AlogP: | -2.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 198.2 | Num_heavy_atoms: | 12 |
| TPSA: | 118.72 | NumAromaticRings: | 0 |
