Glycoside
GD083396
Name:
NoneFormula:
C16H19O8NS2Smiles:
O=S(=O)(Nc1ccc(S[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)cc1)c1ccco1Aglycone:
O=S(=O)(Nc1ccc(S)cc1)c1ccco1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 417.46 | Num_heavy_atoms: | 27 |
| TPSA: | 149.46 | NumAromaticRings: | 2 |
Unique Aglycone
AD37228
Formula: C10H9O3NS2
Smiles:
O=S(=O)(Nc1ccc(S)cc1)c1ccco1| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.0 |
| AlogP: | 2.37 | Num_rotatable_bonds: | 3 |
| MolWt: | 255.32 | Num_heavy_atoms: | 16 |
| TPSA: | 59.31 | NumAromaticRings: | 2 |
