Glycoside
GD087954
Name:
NoneFormula:
C18H24O8N2SSmiles:
CS(=O)(=O)N1C[C@@H]2CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)C[C@H]2c2ccccc21Aglycone:
CS(=O)(=O)N1CC2CNCC2c2ccccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -2.35 | Num_rotatable_bonds: | 6 |
| MolWt: | 428.46 | Num_heavy_atoms: | 29 |
| TPSA: | 155.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD38550
Formula: C12H16O2N2S
Smiles:
CS(=O)(=O)N1CC2CNCC2c2ccccc21| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 1 |
| MolWt: | 252.34 | Num_heavy_atoms: | 17 |
| TPSA: | 49.41 | NumAromaticRings: | 1 |
