Glycoside
GD037224
Name:
NoneFormula:
C16H20O9Smiles:
CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OC(=O)CC(=O)Oc2ccccc2)[C@H]1OAglycone:
O=C(O)CC(=O)Oc1ccccc1Sugarmoiety:
COC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | -1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.33 | Num_heavy_atoms: | 25 |
| TPSA: | 131.75 | NumAromaticRings: | 1 |
Unique Aglycone
AD23462
Formula: C9H8O4
Smiles:
O=C(O)CC(=O)Oc1ccccc1| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 1.07 | Num_rotatable_bonds: | 3 |
| MolWt: | 180.16 | Num_heavy_atoms: | 13 |
| TPSA: | 63.6 | NumAromaticRings: | 1 |
