Glycoside
GD029718
Name:
NoneFormula:
C11H15O5N5SSmiles:
Nc1nc([S+](N)[O-])c2ccn(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
Nc1nc2c(c([S+](N)[O-])n1)C=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.45 |
| AlogP: | -2.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 329.34 | Num_heavy_atoms: | 22 |
| TPSA: | 175.73 | NumAromaticRings: | 2 |
Unique Aglycone
AD19306
Formula: C6H6ON5S
Smiles:
Nc1nc2c(c([S+](N)[O-])n1)C=C[N]2| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 1 |
| MolWt: | 196.22 | Num_heavy_atoms: | 13 |
| TPSA: | 114.98 | NumAromaticRings: | 1 |
