Glycoside
GD050383
Name:
NoneFormula:
C14H19O5N4Smiles:
OC[C@H]1O[C@@H](O)[C@H](Nc2cc(-n3ccnc3)cc[nH+]2)[C@@H](O)[C@@H]1OAglycone:
Nc1cc(-n2ccnc2)cc[nH+]1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.43 |
| AlogP: | -2.1 | Num_rotatable_bonds: | 4 |
| MolWt: | 323.33 | Num_heavy_atoms: | 23 |
| TPSA: | 134.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD26619
Formula: C8H9N4
Smiles:
Nc1cc(-n2ccnc2)cc[nH+]1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.0 |
| AlogP: | 0.27 | Num_rotatable_bonds: | 1 |
| MolWt: | 161.19 | Num_heavy_atoms: | 12 |
| TPSA: | 57.98 | NumAromaticRings: | 2 |
