Glycoside
GD069411
Name:
NoneFormula:
C15H17O5N3Cl2Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2c(Cl)nc(Cl)nc2C2CC2)[C@@H](O)[C@@H]1OAglycone:
Nc1c(Cl)nc(Cl)nc1C1CC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.69 |
| AlogP: | -0.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 366.2 | Num_heavy_atoms: | 23 |
| TPSA: | 127.96 | NumAromaticRings: | 1 |
Unique Aglycone
AD32936
Formula: C9H7N3Cl2
Smiles:
Nc1c(Cl)nc(Cl)nc1C1CC1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.43 |
| AlogP: | 2.24 | Num_rotatable_bonds: | 1 |
| MolWt: | 204.06 | Num_heavy_atoms: | 12 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
