Glycoside
GD022623
Name:
NoneFormula:
C10H14O6N6SSmiles:
Nc1nc(S(N)(=O)=O)c2ncn(C3O[C@H](CO)[C@H](O)[C@H]3O)c2n1Aglycone:
Nc1nc2c(c(S(N)(=O)=O)n1)N=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.5 |
| AlogP: | -3.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 346.33 | Num_heavy_atoms: | 23 |
| TPSA: | 199.7 | NumAromaticRings: | 2 |
Unique Aglycone
AD15317
Formula: C5H5O2N6S
Smiles:
Nc1nc2c(c(S(N)(=O)=O)n1)N=C[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -1.38 | Num_rotatable_bonds: | 1 |
| MolWt: | 213.2 | Num_heavy_atoms: | 14 |
| TPSA: | 138.42 | NumAromaticRings: | 1 |
