Glycoside
GD052920
Name:
NoneFormula:
C14H25O5N5Smiles:
CNCc1cn(C[C@H]2O[C@@H](CC(=O)NCCOC)[C@H](O)[C@@H]2O)nn1Aglycone:
CNCc1cn(C)nn1.COCCNC(C)=OSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -2.36 | Num_rotatable_bonds: | 9 |
| MolWt: | 343.38 | Num_heavy_atoms: | 24 |
| TPSA: | 130.76 | NumAromaticRings: | 1 |
Unique Aglycone
AD13408
Formula: C5H10N4
Smiles:
CNCc1cn(C)nn1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.6 |
| AlogP: | -0.47 | Num_rotatable_bonds: | 2 |
| MolWt: | 126.16 | Num_heavy_atoms: | 9 |
| TPSA: | 42.74 | NumAromaticRings: | 1 |
AD24971
Formula: C5H11O2N
Smiles:
COCCNC(C)=O| HBA: | 3 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | -0.23 | Num_rotatable_bonds: | 3 |
| MolWt: | 117.15 | Num_heavy_atoms: | 8 |
| TPSA: | 38.33 | NumAromaticRings: | 0 |
