Glycoside
GD048087
Name:
NoneFormula:
C11H15O6N3SSmiles:
CSc1nccc(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)n1Aglycone:
CSc1nccc(N)n1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -2.22 | Num_rotatable_bonds: | 7 |
| MolWt: | 317.32 | Num_heavy_atoms: | 21 |
| TPSA: | 152.87 | NumAromaticRings: | 1 |
Unique Aglycone
AD25803
Formula: C5H7N3S
Smiles:
CSc1nccc(N)n1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 1 |
| MolWt: | 141.2 | Num_heavy_atoms: | 9 |
| TPSA: | 51.8 | NumAromaticRings: | 1 |
