Glycoside
GD007969
Name:
NoneFormula:
C15H17O6N7Smiles:
Nc1nc(-c2cnn(CC(=O)O)c2)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(-c2cnn(CC(=O)O)c2)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.4 |
| AlogP: | -2.03 | Num_rotatable_bonds: | 5 |
| MolWt: | 391.34 | Num_heavy_atoms: | 28 |
| TPSA: | 194.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD06423
Formula: C10H8O2N7
Smiles:
Nc1nc(-c2cnn(CC(=O)O)c2)nc2c1N=C[N]2| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.1 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 3 |
| MolWt: | 258.22 | Num_heavy_atoms: | 19 |
| TPSA: | 133.38 | NumAromaticRings: | 2 |
