Glycoside
GD053378
Name:
NoneFormula:
C12H18O6N5Smiles:
Nc1nc2c(c(=O)[nH]1)[n+](CCO)cn2[C@@H]1O[C@@H](CO)[C@@H](O)[C@H]1OAglycone:
Nc1nc2c(c(=O)[nH]1)[N+](CCO)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -3.8 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.31 | Num_heavy_atoms: | 23 |
| TPSA: | 170.73 | NumAromaticRings: | 2 |
Unique Aglycone
AD27259
Formula: C7H9O2N5
Smiles:
Nc1nc2c(c(=O)[nH]1)[N+](CCO)=C[N]2| HBA: | 7 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.29 |
| AlogP: | -1.73 | Num_rotatable_bonds: | 2 |
| MolWt: | 195.18 | Num_heavy_atoms: | 14 |
| TPSA: | 109.11 | NumAromaticRings: | 1 |
