Glycoside
GD028697
Name:
NoneFormula:
C27H32O10Smiles:
COc1cc(O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c(CC=C(C)C)c2c1C(=O)C[C@H](c1ccc(O)cc1)O2Aglycone:
COc1cc(O)c(CC=C(C)C)c2c1C(=O)CC(c1ccc(O)cc1)O2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 7 |
| MolWt: | 516.54 | Num_heavy_atoms: | 37 |
| TPSA: | 155.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD18722
Formula: C21H22O5
Smiles:
COc1cc(O)c(CC=C(C)C)c2c1C(=O)CC(c1ccc(O)cc1)O2| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 4.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 354.4 | Num_heavy_atoms: | 26 |
| TPSA: | 75.99 | NumAromaticRings: | 2 |
