Glycoside
GD155330
Name:
6Alpha-Hydroxyforsythide Dimethyl EsterFormula:
C18H26O12Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C(C(=O)OC)CC(O)C12Aglycone:
COC(=O)C1=COC(O)C2C(C(=O)OC)CC(O)C12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.78 |
| AlogP: | -3.0 | Num_rotatable_bonds: | 5 |
| MolWt: | 434.39 | Num_heavy_atoms: | 30 |
| TPSA: | 181.44 | NumAromaticRings: | 0 |
Unique Aglycone
AD61622
Formula: C12H16O7
Smiles:
COC(=O)C1=COC(O)C2C(C(=O)OC)CC(O)C12| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.67 |
| AlogP: | -0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 272.25 | Num_heavy_atoms: | 19 |
| TPSA: | 102.29 | NumAromaticRings: | 0 |
