Glycoside
GD060151
Name:
NoneFormula:
C13H14O5N3ClSSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2nc(Cl)nc3sccc23)[C@@H](O)[C@@H]1OAglycone:
Nc1nc(Cl)nc2sccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -0.44 | Num_rotatable_bonds: | 3 |
| MolWt: | 347.78 | Num_heavy_atoms: | 22 |
| TPSA: | 127.96 | NumAromaticRings: | 2 |
Unique Aglycone
AD29733
Formula: C7H4N3ClS
Smiles:
Nc1nc(Cl)nc2sccc12| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.93 | Num_rotatable_bonds: | 0 |
| MolWt: | 185.64 | Num_heavy_atoms: | 11 |
| TPSA: | 51.8 | NumAromaticRings: | 2 |
