Glycoside
GD083835
Name:
NoneFormula:
C16H17O7N2ClSSmiles:
COC(=O)c1c(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc2ccsc2c1ClAglycone:
COC(=O)c1c(N)nc2ccsc2c1ClSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 404.83 | Num_heavy_atoms: | 26 |
| TPSA: | 141.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD37370
Formula: C10H7O2N2ClS
Smiles:
COC(=O)c1c(N)nc2ccsc2c1Cl| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 2.32 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.69 | Num_heavy_atoms: | 15 |
| TPSA: | 65.21 | NumAromaticRings: | 2 |
