Glycoside
GD025394
Name:
NoneFormula:
C18H20O5N4Smiles:
COc1nc(N)nc2c1c(-c1ccccc1)cn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
COc1nc(N)nc2c1C(c1ccccc1)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 372.38 | Num_heavy_atoms: | 27 |
| TPSA: | 135.88 | NumAromaticRings: | 3 |
Unique Aglycone
AD16843
Formula: C13H11ON4
Smiles:
COc1nc(N)nc2c1C(c1ccccc1)=C[N]2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 239.26 | Num_heavy_atoms: | 18 |
| TPSA: | 75.13 | NumAromaticRings: | 2 |
