Glycoside
GD088176
Name:
NoneFormula:
C15H17O8N3S2Smiles:
Nc1ccc(S(=O)(=O)N(C(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)c2nccs2)cc1Aglycone:
Nc1ccc(S(=O)(=O)Nc2nccs2)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.27 |
| AlogP: | -1.91 | Num_rotatable_bonds: | 8 |
| MolWt: | 431.45 | Num_heavy_atoms: | 28 |
| TPSA: | 191.35 | NumAromaticRings: | 2 |
Unique Aglycone
AD38607
Formula: C9H9O2N3S2
Smiles:
Nc1ccc(S(=O)(=O)Nc2nccs2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 3 |
| MolWt: | 255.32 | Num_heavy_atoms: | 16 |
| TPSA: | 85.08 | NumAromaticRings: | 2 |
