Glycoside
GD074141
Name:
NoneFormula:
C15H20O8N2SSmiles:
CN1C(=O)Cc2cc(S(=O)(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)ccc21Aglycone:
CN1C(=O)Cc2cc(S(N)(=O)=O)ccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -2.72 | Num_rotatable_bonds: | 4 |
| MolWt: | 388.4 | Num_heavy_atoms: | 26 |
| TPSA: | 156.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD34267
Formula: C9H10O3N2S
Smiles:
CN1C(=O)Cc2cc(S(N)(=O)=O)ccc21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | -0.15 | Num_rotatable_bonds: | 1 |
| MolWt: | 226.26 | Num_heavy_atoms: | 15 |
| TPSA: | 80.47 | NumAromaticRings: | 1 |
