Glycoside
GD064106
Name:
NoneFormula:
C15H18O7N2SSmiles:
O=S(=O)(N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1O)c1cnc2ccccc2c1Aglycone:
NS(=O)(=O)c1cnc2ccccc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | -1.69 | Num_rotatable_bonds: | 4 |
| MolWt: | 370.38 | Num_heavy_atoms: | 25 |
| TPSA: | 149.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD30841
Formula: C9H8O2N2S
Smiles:
NS(=O)(=O)c1cnc2ccccc2c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.88 | Num_rotatable_bonds: | 1 |
| MolWt: | 208.24 | Num_heavy_atoms: | 14 |
| TPSA: | 73.05 | NumAromaticRings: | 2 |
