Glycoside
GD076511
Name:
NoneFormula:
C16H22O7N2SSmiles:
Cc1ccc(S(=O)(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)cc1C#NAglycone:
Cc1ccc(S(=O)(=O)NCCO)cc1C#NSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | -1.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 386.43 | Num_heavy_atoms: | 26 |
| TPSA: | 149.11 | NumAromaticRings: | 1 |
Unique Aglycone
AD35270
Formula: C10H12O3N2S
Smiles:
Cc1ccc(S(=O)(=O)NCCO)cc1C#N| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 240.28 | Num_heavy_atoms: | 16 |
| TPSA: | 90.19 | NumAromaticRings: | 1 |
