Glycoside
GD094944
Name:
NoneFormula:
C19H31O8N3SSmiles:
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.68 |
| AlogP: | -1.77 | Num_rotatable_bonds: | 7 |
| MolWt: | 461.54 | Num_heavy_atoms: | 31 |
| TPSA: | 152.03 | NumAromaticRings: | 1 |
Unique Aglycone
AD40572
Formula: C13H21O3N3S
Smiles:
CCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1N| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.54 |
| AlogP: | 0.6 | Num_rotatable_bonds: | 4 |
| MolWt: | 299.4 | Num_heavy_atoms: | 20 |
| TPSA: | 75.87 | NumAromaticRings: | 1 |
