Glycoside
GD055029
Name:
NoneFormula:
C11H20O8N2SSmiles:
CS(=O)(=O)N1CCN(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)CC1Aglycone:
CS(=O)(=O)N1CCNCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | -4.27 | Num_rotatable_bonds: | 6 |
| MolWt: | 340.35 | Num_heavy_atoms: | 22 |
| TPSA: | 155.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD27948
Formula: C5H12O2N2S
Smiles:
CS(=O)(=O)N1CCNCC1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | -1.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.23 | Num_heavy_atoms: | 10 |
| TPSA: | 49.41 | NumAromaticRings: | 0 |
