Glycoside
GD001390
Name:
NoneFormula:
C14H16O5N8Smiles:
NC(=O)c1cnn(-c2nc(N)c3ncn([C@@H]4O[C@H](CO)[C@H](O)[C@H]4O)c3n2)c1Aglycone:
NC(=O)c1cnn(-c2nc(N)c3c(n2)[N]C=N3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.36 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 4 |
| MolWt: | 376.33 | Num_heavy_atoms: | 27 |
| TPSA: | 200.45 | NumAromaticRings: | 3 |
Unique Aglycone
AD01404
Formula: C9H7ON8
Smiles:
NC(=O)c1cnn(-c2nc(N)c3c(n2)[N]C=N3)c1| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | -0.75 | Num_rotatable_bonds: | 2 |
| MolWt: | 243.21 | Num_heavy_atoms: | 18 |
| TPSA: | 139.17 | NumAromaticRings: | 2 |
