Glycoside
GD013127
Name:
NoneFormula:
C8H12O14N4P3Smiles:
NC(=O)c1ncn([C@@H]2O[C@H](COP(=O)(O)OP(=O)([O-])OP(=O)([O-])[O-])[C@H](O)[C@H]2O)n1Aglycone:
COP(=O)(O)OP(=O)([O-])OP(=O)([O-])[O-].NC(=O)C1=N[N]C=N1Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 18 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -4.56 | Num_rotatable_bonds: | 9 |
| MolWt: | 481.12 | Num_heavy_atoms: | 29 |
| TPSA: | 291.8 | NumAromaticRings: | 1 |
Unique Aglycone
AD00218
Formula: C3H3ON4
Smiles:
NC(=O)C1=N[N]C=N1| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | -1.57 | Num_rotatable_bonds: | 1 |
| MolWt: | 111.08 | Num_heavy_atoms: | 8 |
| TPSA: | 81.91 | NumAromaticRings: | 0 |
AD09837
Formula: CH4O10P3
Smiles:
COP(=O)(O)OP(=O)([O-])OP(=O)([O-])[O-]| HBA: | 10 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -1.94 | Num_rotatable_bonds: | 5 |
| MolWt: | 268.95 | Num_heavy_atoms: | 14 |
| TPSA: | 168.31 | NumAromaticRings: | 0 |
