Glycoside
GD011036
Name:
NoneFormula:
C22H34O13Smiles:
C[C@H](CCc1ccc(O)cc1O)O[C@@H]1O[C@H](CO)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1OAglycone:
CC(O)CCc1ccc(O)cc1OSugarmoiety:
OCC1OC(OC2C(CO)OC(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 9 | FractionCSP3: | 0.73 |
| AlogP: | -2.94 | Num_rotatable_bonds: | 9 |
| MolWt: | 506.5 | Num_heavy_atoms: | 35 |
| TPSA: | 218.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD06736
Formula: C10H14O3
Smiles:
CC(O)CCc1ccc(O)cc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.4 |
| AlogP: | 1.41 | Num_rotatable_bonds: | 3 |
| MolWt: | 182.22 | Num_heavy_atoms: | 13 |
| TPSA: | 60.69 | NumAromaticRings: | 1 |
