Glycoside
GD004412
Name:
NoneFormula:
C22H24O8Smiles:
COc1cc(C(=O)C=Cc2ccccc2)ccc1O[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1cc(C(=O)C=Cc2ccccc2)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.32 |
| AlogP: | 0.77 | Num_rotatable_bonds: | 7 |
| MolWt: | 416.43 | Num_heavy_atoms: | 30 |
| TPSA: | 125.68 | NumAromaticRings: | 2 |
Unique Aglycone
AD03859
Formula: C16H14O3
Smiles:
COc1cc(C(=O)C=Cc2ccccc2)ccc1O| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.06 |
| AlogP: | 3.3 | Num_rotatable_bonds: | 4 |
| MolWt: | 254.29 | Num_heavy_atoms: | 19 |
| TPSA: | 46.53 | NumAromaticRings: | 2 |
