Glycoside
GD062994
Name:
NoneFormula:
C11H16O6N6SSmiles:
CO[C@@H]1[C@H](O)[C@@H](CO)O[C@H]1n1cnc2c(NS(N)(=O)=O)ncnc21Aglycone:
NS(=O)(=O)Nc1ncnc2c1N=C[N]2Sugarmoiety:
COC1C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -2.29 | Num_rotatable_bonds: | 5 |
| MolWt: | 360.35 | Num_heavy_atoms: | 24 |
| TPSA: | 174.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD27264
Formula: C5H5O2N6S
Smiles:
NS(=O)(=O)Nc1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | -1.0 | Num_rotatable_bonds: | 2 |
| MolWt: | 213.2 | Num_heavy_atoms: | 14 |
| TPSA: | 124.43 | NumAromaticRings: | 1 |
