Glycoside
GD097205
Name:
NoneFormula:
C19H22O6N6S2Smiles:
CNC(=O)c1ccc(S(=O)(=O)Nc2ncnc3c2ncn3[C@@H]2O[C@H](CSC)[C@@H](O)[C@H]2O)cc1Aglycone:
CNC(=O)c1ccc(S(=O)(=O)Nc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.37 |
| AlogP: | -0.03 | Num_rotatable_bonds: | 7 |
| MolWt: | 494.56 | Num_heavy_atoms: | 33 |
| TPSA: | 168.56 | NumAromaticRings: | 3 |
Unique Aglycone
AD41324
Formula: C13H11O3N6S
Smiles:
CNC(=O)c1ccc(S(=O)(=O)Nc2ncnc3c2N=C[N]3)cc1| HBA: | 9 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 0.55 | Num_rotatable_bonds: | 4 |
| MolWt: | 331.34 | Num_heavy_atoms: | 23 |
| TPSA: | 127.51 | NumAromaticRings: | 2 |
