Glycoside
GD021760
Name:
NoneFormula:
C13H16O4N6Smiles:
CNc1c(C#N)c2c(N)ncnc2n1[C@@H]1O[C@H](CO)[C@H](O)[C@H]1OAglycone:
CNC1=C(C#N)c2c(N)ncnc2[N]1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.46 |
| AlogP: | -1.46 | Num_rotatable_bonds: | 3 |
| MolWt: | 320.31 | Num_heavy_atoms: | 23 |
| TPSA: | 162.47 | NumAromaticRings: | 2 |
Unique Aglycone
AD14824
Formula: C8H7N6
Smiles:
CNC1=C(C#N)c2c(N)ncnc2[N]1| HBA: | 6 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.12 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 187.19 | Num_heavy_atoms: | 14 |
| TPSA: | 101.72 | NumAromaticRings: | 1 |
