Glycoside
GD062836
Name:
NoneFormula:
C12H17O6N5SSmiles:
CSc1nc2c(nnn2[C@@H]2O[C@@H](CO)[C@@H](O)[C@@H](O)[C@H]2O)c(=O)n1CAglycone:
CSc1nc2c(c(=O)n1C)N=N[N]2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -2.78 | Num_rotatable_bonds: | 3 |
| MolWt: | 359.36 | Num_heavy_atoms: | 24 |
| TPSA: | 155.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD27243
Formula: C6H6ON5S
Smiles:
CSc1nc2c(c(=O)n1C)N=N[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.33 |
| AlogP: | 0.75 | Num_rotatable_bonds: | 1 |
| MolWt: | 196.22 | Num_heavy_atoms: | 13 |
| TPSA: | 73.71 | NumAromaticRings: | 1 |
