Glycoside
GD051849
Name:
NoneFormula:
C15H19O5N3Smiles:
Cc1ccccc1-c1cn([C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
Cc1ccccc1C1=C[N]N=N1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.77 | Num_rotatable_bonds: | 3 |
| MolWt: | 321.33 | Num_heavy_atoms: | 23 |
| TPSA: | 120.86 | NumAromaticRings: | 2 |
Unique Aglycone
AD10759
Formula: C9H8N3
Smiles:
Cc1ccccc1C1=C[N]N=N1| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.11 |
| AlogP: | 2.28 | Num_rotatable_bonds: | 1 |
| MolWt: | 158.18 | Num_heavy_atoms: | 12 |
| TPSA: | 38.82 | NumAromaticRings: | 1 |
