Glycoside
GD082409
Name:
NoneFormula:
C19H31O5N6Smiles:
CC1CC[NH+](C[C@@H](O)CNc2ncnc3c2ncn3[C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)CC1Aglycone:
CC1CC[NH+](CC(O)CNc2ncnc3c2N=C[N]3)CC1Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.74 |
| AlogP: | -2.47 | Num_rotatable_bonds: | 7 |
| MolWt: | 423.49 | Num_heavy_atoms: | 30 |
| TPSA: | 150.22 | NumAromaticRings: | 2 |
Unique Aglycone
AD37035
Formula: C14H22ON6
Smiles:
CC1CC[NH+](CC(O)CNc2ncnc3c2N=C[N]3)CC1| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.64 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 5 |
| MolWt: | 290.37 | Num_heavy_atoms: | 21 |
| TPSA: | 88.94 | NumAromaticRings: | 1 |
