Glycoside
GD046466
Name:
NoneFormula:
C13H14O8Smiles:
COc1ccc(C(=O)O[C@@H](C(=O)O)[C@@H](OC)C(=O)O)cc1Aglycone:
COc1ccc(C=O)cc1Sugarmoiety:
COC(C(=O)O)C(OO)C(=O)OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 0.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 298.25 | Num_heavy_atoms: | 21 |
| TPSA: | 119.36 | NumAromaticRings: | 1 |
Unique Aglycone
AD25385
Formula: C8H8O2
Smiles:
COc1ccc(C=O)cc1| HBA: | 2 | RingCount: | 1 |
| HBD: | 0 | FractionCSP3: | 0.12 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 2 |
| MolWt: | 136.15 | Num_heavy_atoms: | 10 |
| TPSA: | 26.3 | NumAromaticRings: | 1 |
