Glycoside
GD091902
Name:
NoneFormula:
C21H24O5N6Smiles:
O=C(NC1CC1)c1cccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c1Aglycone:
O=C(NC1CC1)c1cccc(CNc2ncnc3c2N=C[N]3)c1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | -0.06 | Num_rotatable_bonds: | 7 |
| MolWt: | 440.46 | Num_heavy_atoms: | 32 |
| TPSA: | 154.65 | NumAromaticRings: | 3 |
Unique Aglycone
AD40091
Formula: C16H15ON6
Smiles:
O=C(NC1CC1)c1cccc(CNc2ncnc3c2N=C[N]3)c1| HBA: | 7 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 5 |
| MolWt: | 307.34 | Num_heavy_atoms: | 23 |
| TPSA: | 93.37 | NumAromaticRings: | 2 |
