Glycoside
GD070508
Name:
NoneFormula:
C18H25O6NClSmiles:
C[C@@H]1O[C@@H](OCC[NH2+][C@@H]2COc3ccc(Cl)cc3C2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
OCC[NH2+]C1COc2ccc(Cl)cc2C1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.65 |
| AlogP: | -0.95 | Num_rotatable_bonds: | 5 |
| MolWt: | 374.84 | Num_heavy_atoms: | 25 |
| TPSA: | 104.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD33425
Formula: C12H15O2NCl
Smiles:
OCC[NH2+]C1COc2ccc(Cl)cc2C1| HBA: | 3 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 0.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 228.7 | Num_heavy_atoms: | 15 |
| TPSA: | 46.07 | NumAromaticRings: | 1 |
