Glycoside
GD038059
Name:
5-iodo-cytidine-5'-monophosphateFormula:
C9H13O8N3PISmiles:
Nc1nc(=O)n([C@H]2O[C@H](COP(=O)(O)O)[C@H](O)[C@@H]2O)cc1IAglycone:
COP(=O)(O)O.Nc1nc(=O)[nH]cc1ISugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.56 |
| AlogP: | -1.84 | Num_rotatable_bonds: | 4 |
| MolWt: | 449.09 | Num_heavy_atoms: | 22 |
| TPSA: | 177.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD00079
Formula: CH5O4P
Smiles:
COP(=O)(O)O| HBA: | 4 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 1.0 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 112.02 | Num_heavy_atoms: | 6 |
| TPSA: | 66.76 | NumAromaticRings: | 0 |
AD07267
Formula: C4H4ON3I
Smiles:
Nc1nc(=O)[nH]cc1I| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -0.04 | Num_rotatable_bonds: | 0 |
| MolWt: | 237.0 | Num_heavy_atoms: | 9 |
| TPSA: | 71.77 | NumAromaticRings: | 1 |
