Glycoside
GD075584
Name:
NoneFormula:
C16H19O7N3SSmiles:
O=S(=O)(c1ccccc1)c1ccc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
Nc1ccc(S(=O)(=O)c2ccccc2)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -1.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 397.41 | Num_heavy_atoms: | 27 |
| TPSA: | 162.1 | NumAromaticRings: | 2 |
Unique Aglycone
AD35020
Formula: C10H9O2N3S
Smiles:
Nc1ccc(S(=O)(=O)c2ccccc2)nn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 235.27 | Num_heavy_atoms: | 16 |
| TPSA: | 85.94 | NumAromaticRings: | 2 |
