Glycoside
GD098560
Name:
NoneFormula:
C21H24O9N2SSmiles:
CN1C(=O)Cc2cc(S(=O)(=O)Nc3ccc(O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)cc3)ccc21Aglycone:
CN1C(=O)Cc2cc(S(=O)(=O)Nc3ccc(O)cc3)ccc21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.81 | Num_rotatable_bonds: | 6 |
| MolWt: | 480.5 | Num_heavy_atoms: | 33 |
| TPSA: | 165.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD41913
Formula: C15H14O4N2S
Smiles:
CN1C(=O)Cc2cc(S(=O)(=O)Nc3ccc(O)cc3)ccc21| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 1.71 | Num_rotatable_bonds: | 3 |
| MolWt: | 318.35 | Num_heavy_atoms: | 22 |
| TPSA: | 86.71 | NumAromaticRings: | 2 |
