Glycoside
GD026078
Name:
NoneFormula:
C12H15O6N5SSmiles:
Nc1nc(SCC(=O)O)nc2c1ncn2[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
Nc1nc(SCC(=O)O)nc2c1N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | -1.8 | Num_rotatable_bonds: | 5 |
| MolWt: | 357.35 | Num_heavy_atoms: | 24 |
| TPSA: | 176.84 | NumAromaticRings: | 2 |
Unique Aglycone
AD17216
Formula: C7H6O2N5S
Smiles:
Nc1nc(SCC(=O)O)nc2c1N=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.14 |
| AlogP: | 0.14 | Num_rotatable_bonds: | 3 |
| MolWt: | 224.23 | Num_heavy_atoms: | 15 |
| TPSA: | 115.56 | NumAromaticRings: | 1 |
