Glycoside
GD098769
Name:
NoneFormula:
C20H22O9N2SSmiles:
O=S(=O)(Cc1noc2ccccc12)Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1Aglycone:
O=S(=O)(Cc1noc2ccccc12)Nc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.35 |
| AlogP: | -0.05 | Num_rotatable_bonds: | 7 |
| MolWt: | 466.47 | Num_heavy_atoms: | 32 |
| TPSA: | 171.58 | NumAromaticRings: | 3 |
Unique Aglycone
AD42017
Formula: C14H12O4N2S
Smiles:
O=S(=O)(Cc1noc2ccccc12)Nc1ccc(O)cc1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.48 | Num_rotatable_bonds: | 4 |
| MolWt: | 304.33 | Num_heavy_atoms: | 21 |
| TPSA: | 92.43 | NumAromaticRings: | 3 |
