Glycoside
GD023384
Name:
NoneFormula:
C13H16O5Smiles:
O=C(C[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O)c1ccccc1Aglycone:
CC(=O)c1ccccc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.46 |
| AlogP: | -0.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 252.27 | Num_heavy_atoms: | 18 |
| TPSA: | 86.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD15736
Formula: C8H8O
Smiles:
CC(=O)c1ccccc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 120.15 | Num_heavy_atoms: | 9 |
| TPSA: | 17.07 | NumAromaticRings: | 1 |
