Glycoside
GD047244
Name:
NoneFormula:
C10H14O6N6Smiles:
Nc1nc2c(nc(NO)n2[C@@H]2O[C@H](CO)[C@H](O)[C@@H]2O)c(=O)[nH]1Aglycone:
Nc1nc2c(c(=O)[nH]1)N=C(NO)[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.5 |
| AlogP: | -2.89 | Num_rotatable_bonds: | 3 |
| MolWt: | 314.26 | Num_heavy_atoms: | 22 |
| TPSA: | 191.77 | NumAromaticRings: | 2 |
Unique Aglycone
AD25454
Formula: C5H5O2N6
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C(NO)[N]2| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.0 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 0 |
| MolWt: | 181.14 | Num_heavy_atoms: | 13 |
| TPSA: | 130.49 | NumAromaticRings: | 1 |
