Glycoside
GD090201
Name:
NoneFormula:
C16H21O7N3S2Smiles:
Cn1cc(S(=O)(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@@H]3O)cc2)cn1Aglycone:
Cn1cc(S(=O)(=O)Nc2ccc(S)cc2)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 6 |
| MolWt: | 431.49 | Num_heavy_atoms: | 28 |
| TPSA: | 154.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD39245
Formula: C10H11O2N3S2
Smiles:
Cn1cc(S(=O)(=O)Nc2ccc(S)cc2)cn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.1 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 269.35 | Num_heavy_atoms: | 17 |
| TPSA: | 63.99 | NumAromaticRings: | 2 |
