Glycoside
GD084475
Name:
NoneFormula:
C16H23O7NS2Smiles:
O=S(=O)(CC1CC1)Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@@H]2O)cc1Aglycone:
O=S(=O)(CC1CC1)Nc1ccc(S)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.27 | Num_rotatable_bonds: | 7 |
| MolWt: | 405.49 | Num_heavy_atoms: | 26 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD37729
Formula: C10H13O2NS2
Smiles:
O=S(=O)(CC1CC1)Nc1ccc(S)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.4 |
| AlogP: | 2.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 243.35 | Num_heavy_atoms: | 15 |
| TPSA: | 46.17 | NumAromaticRings: | 1 |
