Glycoside
GD026253
Name:
NoneFormula:
C18H20O4N4Smiles:
CNc1ncnc2c1c(-c1ccccc1)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CNc1ncnc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 4 |
| MolWt: | 356.38 | Num_heavy_atoms: | 26 |
| TPSA: | 112.66 | NumAromaticRings: | 3 |
Unique Aglycone
AD17318
Formula: C13H11N4
Smiles:
CNc1ncnc2c1C(c1ccccc1)=C[N]2| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.08 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 2 |
| MolWt: | 223.26 | Num_heavy_atoms: | 17 |
| TPSA: | 51.91 | NumAromaticRings: | 2 |
