Glycoside
GD097599
Name:
NoneFormula:
C21H25O8N3SSmiles:
COc1ncc(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c2ccn(S(=O)(=O)c3ccc(C)cc3)c12Aglycone:
COc1ncc(N)c2ccn(S(=O)(=O)c3ccc(C)cc3)c12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 6 |
| MolWt: | 479.51 | Num_heavy_atoms: | 33 |
| TPSA: | 163.37 | NumAromaticRings: | 3 |
Unique Aglycone
AD41540
Formula: C15H15O3N3S
Smiles:
COc1ncc(N)c2ccn(S(=O)(=O)c3ccc(C)cc3)c12| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 2.17 | Num_rotatable_bonds: | 3 |
| MolWt: | 317.37 | Num_heavy_atoms: | 22 |
| TPSA: | 87.21 | NumAromaticRings: | 3 |
