Glycoside
GD045603
Name:
NoneFormula:
C11H14O4N4SSmiles:
Cn1cnc2c(ncn2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)c1=SAglycone:
Cn1cnc2c(c1=S)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.55 |
| AlogP: | -0.89 | Num_rotatable_bonds: | 2 |
| MolWt: | 298.32 | Num_heavy_atoms: | 20 |
| TPSA: | 105.56 | NumAromaticRings: | 2 |
Unique Aglycone
AD14095
Formula: C6H5N4S
Smiles:
Cn1cnc2c(c1=S)N=C[N]2| HBA: | 4 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.17 |
| AlogP: | 1.06 | Num_rotatable_bonds: | 0 |
| MolWt: | 165.2 | Num_heavy_atoms: | 11 |
| TPSA: | 44.28 | NumAromaticRings: | 1 |
