Glycoside
GD088458
Name:
NoneFormula:
C17H24O8N2S2Smiles:
CS(=O)(=O)N1CC(C(=O)Nc2ccc(S[C@@H]3O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]3O)cc2)C1Aglycone:
CS(=O)(=O)N1CC(C(=O)Nc2ccc(S)cc2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.59 |
| AlogP: | -1.59 | Num_rotatable_bonds: | 6 |
| MolWt: | 448.52 | Num_heavy_atoms: | 29 |
| TPSA: | 156.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD38695
Formula: C11H14O3N2S2
Smiles:
CS(=O)(=O)N1CC(C(=O)Nc2ccc(S)cc2)C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 0.81 | Num_rotatable_bonds: | 3 |
| MolWt: | 286.38 | Num_heavy_atoms: | 18 |
| TPSA: | 66.48 | NumAromaticRings: | 1 |
