Glycoside
GD001812
Name:
NoneFormula:
C23H28O6Smiles:
COc1cc(C)c(Cc2ccc3c(c2)CC3)cc1[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1OAglycone:
COc1ccc(Cc2ccc3c(c2)CC3)c(C)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 1.21 | Num_rotatable_bonds: | 5 |
| MolWt: | 400.47 | Num_heavy_atoms: | 29 |
| TPSA: | 99.38 | NumAromaticRings: | 2 |
Unique Aglycone
AD01774
Formula: C17H18O
Smiles:
COc1ccc(Cc2ccc3c(c2)CC3)c(C)c1| HBA: | 1 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 3.69 | Num_rotatable_bonds: | 3 |
| MolWt: | 238.33 | Num_heavy_atoms: | 18 |
| TPSA: | 9.23 | NumAromaticRings: | 2 |
