Glycoside
GD066818
Name:
NoneFormula:
C14H23O8N3Smiles:
CCC(=O)OCc1cn(CCO[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
CCC(=O)OCc1cn(CCO)nn1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -2.45 | Num_rotatable_bonds: | 9 |
| MolWt: | 361.35 | Num_heavy_atoms: | 25 |
| TPSA: | 156.39 | NumAromaticRings: | 1 |
Unique Aglycone
AD31953
Formula: C8H13O3N3
Smiles:
CCC(=O)OCc1cn(CCO)nn1| HBA: | 6 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.62 |
| AlogP: | -0.28 | Num_rotatable_bonds: | 5 |
| MolWt: | 199.21 | Num_heavy_atoms: | 14 |
| TPSA: | 77.24 | NumAromaticRings: | 1 |
