Glycoside
GD031418
Name:
NoneFormula:
C12H18O6N5Smiles:
Nc1nc(O)c2c(n1)[n+](C1O[C@H](CO)[C@H](O)[C@H]1O)cn2CCOAglycone:
Nc1nc(O)c2c(n1)[nH+]cn2CCOSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -3.39 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.31 | Num_heavy_atoms: | 23 |
| TPSA: | 170.99 | NumAromaticRings: | 2 |
Unique Aglycone
AD01403
Formula: C7H10O2N5
Smiles:
Nc1nc(O)c2c(n1)[nH+]cn2CCO| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | -1.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 196.19 | Num_heavy_atoms: | 14 |
| TPSA: | 111.33 | NumAromaticRings: | 2 |
