Glycoside
GD027737
Name:
NoneFormula:
C22H30O7Smiles:
COc1cc(C)c2cc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(C)cc2c1C(C)CAglycone:
COc1cc(C)c2cc(O)c(C)cc2c1C(C)CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.55 |
| AlogP: | 1.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.48 | Num_heavy_atoms: | 29 |
| TPSA: | 108.61 | NumAromaticRings: | 2 |
Unique Aglycone
AD18199
Formula: C16H20O2
Smiles:
COc1cc(C)c2cc(O)c(C)cc2c1C(C)C| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.38 |
| AlogP: | 4.29 | Num_rotatable_bonds: | 2 |
| MolWt: | 244.33 | Num_heavy_atoms: | 18 |
| TPSA: | 29.46 | NumAromaticRings: | 2 |
