Glycoside
GD089007
Name:
NoneFormula:
C17H19O7N5SSmiles:
Cc1ccc(S(=O)(=O)Nc2c(C(N)=O)ncn2[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1C#NAglycone:
Cc1ccc(S(=O)(=O)NC2=C(C(N)=O)N=C[N]2)cc1C#NSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.35 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 6 |
| MolWt: | 437.43 | Num_heavy_atoms: | 30 |
| TPSA: | 200.79 | NumAromaticRings: | 2 |
Unique Aglycone
AD38900
Formula: C12H10O3N5S
Smiles:
Cc1ccc(S(=O)(=O)NC2=C(C(N)=O)N=C[N]2)cc1C#N| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.08 |
| AlogP: | -0.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 304.31 | Num_heavy_atoms: | 21 |
| TPSA: | 139.51 | NumAromaticRings: | 1 |
