Glycoside
GD080171
Name:
NoneFormula:
C16H21O8N3SSmiles:
Cn1cc(S(=O)(=O)Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)cn1Aglycone:
Cn1cc(S(=O)(=O)Nc2ccc(O)cc2)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 6 |
| MolWt: | 415.42 | Num_heavy_atoms: | 28 |
| TPSA: | 163.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD36428
Formula: C10H11O3N3S
Smiles:
Cn1cc(S(=O)(=O)Nc2ccc(O)cc2)cn1| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 0.93 | Num_rotatable_bonds: | 3 |
| MolWt: | 253.28 | Num_heavy_atoms: | 17 |
| TPSA: | 84.22 | NumAromaticRings: | 2 |
