Glycoside
GD048919
Name:
NoneFormula:
C12H15O7NSSmiles:
CC(=O)c1ccsc1NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
CC(=O)c1ccsc1NSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 317.32 | Num_heavy_atoms: | 21 |
| TPSA: | 144.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD25993
Formula: C6H7ONS
Smiles:
CC(=O)c1ccsc1N| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 1 |
| MolWt: | 141.19 | Num_heavy_atoms: | 9 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
