Glycoside
GD092411
Name:
NoneFormula:
C19H32O8N4Smiles:
C=CCN(Cc1cn(CCO[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1)C(=O)OC(C)(C)CAglycone:
C=CCN(Cc1cn(CCO)nn1)C(=O)OC(C)(C)CSugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.74 |
| AlogP: | -0.98 | Num_rotatable_bonds: | 10 |
| MolWt: | 444.49 | Num_heavy_atoms: | 31 |
| TPSA: | 159.63 | NumAromaticRings: | 1 |
Unique Aglycone
AD40322
Formula: C13H22O3N4
Smiles:
C=CCN(Cc1cn(CCO)nn1)C(=O)OC(C)(C)C| HBA: | 7 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 6 |
| MolWt: | 282.34 | Num_heavy_atoms: | 20 |
| TPSA: | 80.48 | NumAromaticRings: | 1 |
