Glycoside
GD097376
Name:
NoneFormula:
C17H20O8N2Cl2SSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2cc(S(N)(=O)=O)c(Cl)cc2Cl)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
NS(=O)(=O)c1cc(C(=O)NCCO)c(Cl)cc1ClSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.53 |
| AlogP: | -0.79 | Num_rotatable_bonds: | 6 |
| MolWt: | 459.3 | Num_heavy_atoms: | 28 |
| TPSA: | 168.41 | NumAromaticRings: | 1 |
Unique Aglycone
AD41403
Formula: C11H10O4N2Cl2S
Smiles:
NS(=O)(=O)c1cc(C(=O)NCCO)c(Cl)cc1Cl| HBA: | 6 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.22 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 4 |
| MolWt: | 313.16 | Num_heavy_atoms: | 18 |
| TPSA: | 109.49 | NumAromaticRings: | 1 |
