Glycoside
GD116816
Name:
NoneFormula:
C22H34O14Smiles:
OCC1=CC(O)C2(OC3CC(CO)C(O)C(O)C3O)C=COC(OC3OC(CO)C(O)C(O)C3O)C12Aglycone:
OCC1=CC(O)C2(OC3CC(CO)C(O)C(O)C3O)C=COC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 10 | FractionCSP3: | 0.82 |
| AlogP: | -5.2 | Num_rotatable_bonds: | 7 |
| MolWt: | 522.5 | Num_heavy_atoms: | 36 |
| TPSA: | 239.22 | NumAromaticRings: | 0 |
Unique Aglycone
AD46464
Formula: C16H24O9
Smiles:
OCC1=CC(O)C2(OC3CC(CO)C(O)C(O)C3O)C=COC(O)C12| HBA: | 9 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.75 |
| AlogP: | -3.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 360.36 | Num_heavy_atoms: | 25 |
| TPSA: | 160.07 | NumAromaticRings: | 0 |
