Glycoside
GD033157
Name:
NoneFormula:
C12H14O5N4Smiles:
Nc1ncnc2c1c(=O)ccn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1ncnc2c1C(=O)C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -2.01 | Num_rotatable_bonds: | 2 |
| MolWt: | 294.27 | Num_heavy_atoms: | 21 |
| TPSA: | 143.72 | NumAromaticRings: | 2 |
Unique Aglycone
AD04080
Formula: C7H5ON4
Smiles:
Nc1ncnc2c1C(=O)C=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.0 | Num_rotatable_bonds: | 0 |
| MolWt: | 161.14 | Num_heavy_atoms: | 12 |
| TPSA: | 82.97 | NumAromaticRings: | 1 |
