Glycoside
GD070226
Name:
NoneFormula:
C15H18O4N5ClSmiles:
CC/C(C)=N/c1nc(Cl)nc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1OAglycone:
CCC(C)=Nc1nc(Cl)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 4 |
| MolWt: | 355.78 | Num_heavy_atoms: | 24 |
| TPSA: | 125.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD33260
Formula: C10H9N5Cl
Smiles:
CCC(C)=Nc1nc(Cl)nc2c1N=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 2.54 | Num_rotatable_bonds: | 2 |
| MolWt: | 222.66 | Num_heavy_atoms: | 15 |
| TPSA: | 64.6 | NumAromaticRings: | 1 |
