Glycoside
GD067068
Name:
NoneFormula:
C12H14O7N4SSmiles:
O=[N+]([O-])c1cc2c(N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)ncnc2s1Aglycone:
Nc1ncnc2sc([N+](=O)[O-])cc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -1.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 358.33 | Num_heavy_atoms: | 24 |
| TPSA: | 171.1 | NumAromaticRings: | 2 |
Unique Aglycone
AD32053
Formula: C6H4O2N4S
Smiles:
Nc1ncnc2sc([N+](=O)[O-])cc12| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.18 | Num_rotatable_bonds: | 1 |
| MolWt: | 196.19 | Num_heavy_atoms: | 13 |
| TPSA: | 94.94 | NumAromaticRings: | 2 |
