Glycoside
GD009343
Name:
NoneFormula:
C17H22O6N2SSmiles:
CC(C)NC(=O)c1ccc2sc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2c1Aglycone:
CC(C)NC(=O)c1ccc2scnc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 382.44 | Num_heavy_atoms: | 26 |
| TPSA: | 132.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD07332
Formula: C11H12ON2S
Smiles:
CC(C)NC(=O)c1ccc2scnc2c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 2.43 | Num_rotatable_bonds: | 2 |
| MolWt: | 220.3 | Num_heavy_atoms: | 15 |
| TPSA: | 41.99 | NumAromaticRings: | 2 |
