Glycoside
GD029491
Name:
NoneFormula:
C17H22O8Smiles:
COc1cc(C=CC(C)=O)ccc1OC1OC(CO)C(O)C(O)C1OAglycone:
COc1cc(C=CC(C)=O)ccc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 6 |
| MolWt: | 354.36 | Num_heavy_atoms: | 25 |
| TPSA: | 125.68 | NumAromaticRings: | 1 |
Unique Aglycone
AD03950
Formula: C11H12O3
Smiles:
COc1cc(C=CC(C)=O)ccc1O| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.18 |
| AlogP: | 2.0 | Num_rotatable_bonds: | 3 |
| MolWt: | 192.21 | Num_heavy_atoms: | 14 |
| TPSA: | 46.53 | NumAromaticRings: | 1 |
