Glycoside
GD088521
Name:
NoneFormula:
C18H22O8N2SSmiles:
Cc1ccc(S(=O)(=O)n2ccc(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2)cc1Aglycone:
Cc1ccc(S(=O)(=O)n2ccc(C(N)=O)c2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.39 |
| AlogP: | -1.44 | Num_rotatable_bonds: | 5 |
| MolWt: | 426.45 | Num_heavy_atoms: | 29 |
| TPSA: | 158.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD38724
Formula: C12H12O3N2S
Smiles:
Cc1ccc(S(=O)(=O)n2ccc(C(N)=O)c2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.13 | Num_rotatable_bonds: | 3 |
| MolWt: | 264.31 | Num_heavy_atoms: | 18 |
| TPSA: | 82.16 | NumAromaticRings: | 2 |
