Glycoside
GD092121
Name:
NoneFormula:
C21H29O5N6Smiles:
C[NH+](C)CCOc1ccc(CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)cc1Aglycone:
C[NH+](C)CCOc1ccc(CNc2ncnc3c2N=C[N]3)cc1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.48 |
| AlogP: | -1.43 | Num_rotatable_bonds: | 9 |
| MolWt: | 445.5 | Num_heavy_atoms: | 32 |
| TPSA: | 139.22 | NumAromaticRings: | 3 |
Unique Aglycone
AD40218
Formula: C16H20ON6
Smiles:
C[NH+](C)CCOc1ccc(CNc2ncnc3c2N=C[N]3)cc1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 0.52 | Num_rotatable_bonds: | 7 |
| MolWt: | 312.38 | Num_heavy_atoms: | 23 |
| TPSA: | 77.94 | NumAromaticRings: | 2 |
