Glycoside
GD133209
Name:
FeruloylglycosideFormula:
C16H20O9Smiles:
COc1ccc(C=CC(=O)O)cc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1ccc(C=CC(=O)O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -1.03 | Num_rotatable_bonds: | 6 |
| MolWt: | 356.33 | Num_heavy_atoms: | 25 |
| TPSA: | 145.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD12114
Formula: C10H10O4
Smiles:
COc1ccc(C=CC(=O)O)cc1O| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.1 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 3 |
| MolWt: | 194.19 | Num_heavy_atoms: | 14 |
| TPSA: | 66.76 | NumAromaticRings: | 1 |
