Glycoside
GD097814
Name:
NoneFormula:
C21H26O8N2SSmiles:
CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)ccc1CAglycone:
CCN(c1ccccc1)S(=O)(=O)c1cc(N)ccc1CSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.21 | Num_rotatable_bonds: | 10 |
| MolWt: | 466.51 | Num_heavy_atoms: | 32 |
| TPSA: | 164.47 | NumAromaticRings: | 2 |
Unique Aglycone
AD41625
Formula: C15H18O2N2S
Smiles:
CCN(c1ccccc1)S(=O)(=O)c1cc(N)ccc1C| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.2 |
| AlogP: | 2.79 | Num_rotatable_bonds: | 4 |
| MolWt: | 290.39 | Num_heavy_atoms: | 20 |
| TPSA: | 63.4 | NumAromaticRings: | 2 |
