Glycoside
GD003676
Name:
NoneFormula:
C21H22O9Smiles:
CC(C(=O)OC1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)c1cccc(Oc2ccccc2)c1Aglycone:
CC(C(=O)O)c1cccc(Oc2ccccc2)c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 1.02 | Num_rotatable_bonds: | 6 |
| MolWt: | 418.4 | Num_heavy_atoms: | 30 |
| TPSA: | 142.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD03307
Formula: C15H14O3
Smiles:
CC(C(=O)O)c1cccc(Oc2ccccc2)c1| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.13 |
| AlogP: | 3.67 | Num_rotatable_bonds: | 4 |
| MolWt: | 242.27 | Num_heavy_atoms: | 18 |
| TPSA: | 46.53 | NumAromaticRings: | 2 |
