Glycoside
GD014893
Name:
NoneFormula:
C21H22O10Smiles:
CC(C(=O)OC1O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]1O)c1cccc(Oc2ccc(O)cc2)c1Aglycone:
CC(C(=O)O)c1cccc(Oc2ccc(O)cc2)c1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 0.72 | Num_rotatable_bonds: | 6 |
| MolWt: | 434.4 | Num_heavy_atoms: | 31 |
| TPSA: | 162.98 | NumAromaticRings: | 2 |
Unique Aglycone
AD10908
Formula: C15H14O4
Smiles:
CC(C(=O)O)c1cccc(Oc2ccc(O)cc2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 3.37 | Num_rotatable_bonds: | 4 |
| MolWt: | 258.27 | Num_heavy_atoms: | 19 |
| TPSA: | 66.76 | NumAromaticRings: | 2 |
