Glycoside
GD035979
Name:
NoneFormula:
C18H18O5N7ClSmiles:
Nc1nc(NN=Cc2ccc(Cl)cc2O)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(NN=Cc2ccc(Cl)cc2O)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.29 |
| AlogP: | -0.18 | Num_rotatable_bonds: | 5 |
| MolWt: | 435.83 | Num_heavy_atoms: | 30 |
| TPSA: | 184.16 | NumAromaticRings: | 3 |
Unique Aglycone
AD22738
Formula: C13H9ON7Cl
Smiles:
Nc1nc(NN=Cc2ccc(Cl)cc2O)nc2c1N=C[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 302.71 | Num_heavy_atoms: | 21 |
| TPSA: | 122.88 | NumAromaticRings: | 2 |
