Glycoside
GD008707
Name:
NoneFormula:
C18H20O6N6Smiles:
C[C@]1(O)C(n2cnc3c(N(O)C(=O)Nc4ccccc4)ncnc32)O[C@H](CO)[C@H]1OAglycone:
O=C(Nc1ccccc1)N(O)c1ncnc2c1N=C[N]2Sugarmoiety:
CC1(O)C(O)OC(CO)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.26 | Num_rotatable_bonds: | 4 |
| MolWt: | 416.39 | Num_heavy_atoms: | 30 |
| TPSA: | 166.09 | NumAromaticRings: | 3 |
Unique Aglycone
AD06920
Formula: C12H9O2N6
Smiles:
O=C(Nc1ccccc1)N(O)c1ncnc2c1N=C[N]2| HBA: | 8 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 2 |
| MolWt: | 269.24 | Num_heavy_atoms: | 20 |
| TPSA: | 104.81 | NumAromaticRings: | 2 |
