Glycoside
GD062341
Name:
NoneFormula:
C12H18O8N2SSmiles:
NS(=O)(=O)c1ccc(N[C@]2(O)O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]2O)cc1Aglycone:
Nc1ccc(S(N)(=O)=O)cc1Sugarmoiety:
OCC1OC(O)(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 8 | FractionCSP3: | 0.5 |
| AlogP: | -3.13 | Num_rotatable_bonds: | 4 |
| MolWt: | 350.35 | Num_heavy_atoms: | 23 |
| TPSA: | 182.57 | NumAromaticRings: | 1 |
Unique Aglycone
AD03961
Formula: C6H8O2N2S
Smiles:
Nc1ccc(S(N)(=O)=O)cc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.08 | Num_rotatable_bonds: | 1 |
| MolWt: | 172.21 | Num_heavy_atoms: | 11 |
| TPSA: | 86.18 | NumAromaticRings: | 1 |
