Glycoside
GD101267
Name:
NoneFormula:
C23H30O8N2SSmiles:
O=S(=O)(c1ccc(Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)cc1)N1CCCCC1Aglycone:
O=S(=O)(c1ccc(Nc2ccc(O)cc2)cc1)N1CCCCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | 0.78 | Num_rotatable_bonds: | 7 |
| MolWt: | 494.57 | Num_heavy_atoms: | 34 |
| TPSA: | 148.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD42836
Formula: C17H20O3N2S
Smiles:
O=S(=O)(c1ccc(Nc2ccc(O)cc2)cc1)N1CCCCC1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 3.31 | Num_rotatable_bonds: | 4 |
| MolWt: | 332.43 | Num_heavy_atoms: | 23 |
| TPSA: | 69.64 | NumAromaticRings: | 2 |
