Glycoside
GD000324
Name:
NoneFormula:
C23H30O10Smiles:
COc1ccc(OCC(CO[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)Oc2ccc(OC)cc2)cc1Aglycone:
COc1ccc(OCC(CO)Oc2ccc(OC)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 11 |
| MolWt: | 466.48 | Num_heavy_atoms: | 33 |
| TPSA: | 136.3 | NumAromaticRings: | 2 |
Unique Aglycone
AD00368
Formula: C17H20O5
Smiles:
COc1ccc(OCC(CO)Oc2ccc(OC)cc2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.29 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 8 |
| MolWt: | 304.34 | Num_heavy_atoms: | 22 |
| TPSA: | 57.15 | NumAromaticRings: | 2 |
