Glycoside
GD091735
Name:
NoneFormula:
C19H22O8N3ClSmiles:
COC(=O)c1ccc(-c2cn(CCO[C@]3(CO)O[C@H](CO)[C@@H](O)[C@@H]3O)nn2)cc1ClAglycone:
COC(=O)c1ccc(-c2cn(CCO)nn2)cc1ClSugarmoiety:
OCC1OC(O)(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | -0.8 | Num_rotatable_bonds: | 8 |
| MolWt: | 443.84 | Num_heavy_atoms: | 30 |
| TPSA: | 156.39 | NumAromaticRings: | 2 |
Unique Aglycone
AD40013
Formula: C13H12O3N3Cl
Smiles:
COC(=O)c1ccc(-c2cn(CCO)nn2)cc1Cl| HBA: | 6 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.25 |
| AlogP: | 1.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 281.7 | Num_heavy_atoms: | 19 |
| TPSA: | 77.24 | NumAromaticRings: | 2 |
