Glycoside
GD027054
Name:
NoneFormula:
C19H23O9N6PSmiles:
Nc1ncnc2c1nc(-c1ccc(CC(N)C(=O)O)cc1)n2[C@@H]1O[C@H](COP(=O)(O)O)[C@H](O)[C@H]1OAglycone:
COP(=O)(O)O.Nc1ncnc2c1N=C(c1ccc(CC(N)C(=O)O)cc1)[N]2Sugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 15 | RingCount: | 4 |
| HBD: | 9 | FractionCSP3: | 0.37 |
| AlogP: | -1.24 | Num_rotatable_bonds: | 8 |
| MolWt: | 510.4 | Num_heavy_atoms: | 35 |
| TPSA: | 249.39 | NumAromaticRings: | 3 |
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 |
AD17804
Formula: C14H13O2N6
Smiles:
Nc1ncnc2c1N=C(c1ccc(CC(N)C(=O)O)cc1)[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.14 |
| AlogP: | 0.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 297.3 | Num_heavy_atoms: | 22 |
| TPSA: | 141.58 | NumAromaticRings: | 2 |
