Glycoside
GD100324
Name:
NoneFormula:
C20H24O7N4SSmiles:
COc1cc(C)c(S(=O)(=O)Nc2ncnc3c2ccn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(C)c1Aglycone:
COc1cc(C)c(S(=O)(=O)Nc2ncnc3c2C=C[N]3)c(C)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.4 |
| AlogP: | 0.47 | Num_rotatable_bonds: | 6 |
| MolWt: | 464.5 | Num_heavy_atoms: | 32 |
| TPSA: | 156.03 | NumAromaticRings: | 3 |
Unique Aglycone
AD42391
Formula: C15H15O3N4S
Smiles:
COc1cc(C)c(S(=O)(=O)Nc2ncnc3c2C=C[N]3)c(C)c1| HBA: | 7 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 2.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 331.38 | Num_heavy_atoms: | 23 |
| TPSA: | 95.28 | NumAromaticRings: | 2 |
