Glycoside
GD073881
Name:
NoneFormula:
C17H23O7N3Smiles:
COc1ccccc1-c1cn(CCO[C@]2(CO)O[C@H](CO)[C@@H](O)[C@@H]2O)nn1Aglycone:
COc1ccccc1-c1cn(CCO)nn1Sugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.23 | Num_rotatable_bonds: | 8 |
| MolWt: | 381.38 | Num_heavy_atoms: | 27 |
| TPSA: | 139.32 | NumAromaticRings: | 2 |
Unique Aglycone
AD34178
Formula: C11H13O2N3
Smiles:
COc1ccccc1-c1cn(CCO)nn1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.27 |
| AlogP: | 0.95 | Num_rotatable_bonds: | 4 |
| MolWt: | 219.24 | Num_heavy_atoms: | 16 |
| TPSA: | 60.17 | NumAromaticRings: | 2 |
