Glycoside
GD071801
Name:
NoneFormula:
C17H27O5N6Smiles:
COCC[N@H+]1CC[C@@H](Nc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)C1Aglycone:
COCC[NH+]1CCC(Nc2ncnc3c2N=C[N]3)C1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -2.85 | Num_rotatable_bonds: | 7 |
| MolWt: | 395.44 | Num_heavy_atoms: | 28 |
| TPSA: | 139.22 | NumAromaticRings: | 2 |
Unique Aglycone
AD33723
Formula: C12H18ON6
Smiles:
COCC[NH+]1CCC(Nc2ncnc3c2N=C[N]3)C1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.58 |
| AlogP: | -0.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 262.32 | Num_heavy_atoms: | 19 |
| TPSA: | 77.94 | NumAromaticRings: | 1 |
