Glycoside
GD084523
Name:
NoneFormula:
C18H27O8NSSmiles:
O=S(=O)(CC1CCCC1)Nc1ccc(O[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]2O)cc1Aglycone:
O=S(=O)(CC1CCCC1)Nc1ccc(O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 7 |
| MolWt: | 417.48 | Num_heavy_atoms: | 28 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD37758
Formula: C12H17O3NS
Smiles:
O=S(=O)(CC1CCCC1)Nc1ccc(O)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 255.34 | Num_heavy_atoms: | 17 |
| TPSA: | 66.4 | NumAromaticRings: | 1 |
