Glycoside
GD152463
Name:
2-(hydroxymethyl)-6-[2,4,6-trihydroxy-3-(3-hydroxy-4-methoxybenzoyl)phenyl]oxane-3,4,5-triolFormula:
C20H22O11Smiles:
COc1ccc(C(=O)c2c(O)cc(O)c(C3OC(CO)C(O)C(O)C3O)c2O)cc1OAglycone:
COc1ccc(C(=O)c2c(O)cc(O)cc2O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.35 |
| AlogP: | -0.74 | Num_rotatable_bonds: | 5 |
| MolWt: | 438.39 | Num_heavy_atoms: | 31 |
| TPSA: | 197.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD60703
Formula: C14H12O6
Smiles:
COc1ccc(C(=O)c2c(O)cc(O)cc2O)cc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.07 |
| AlogP: | 1.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 276.24 | Num_heavy_atoms: | 20 |
| TPSA: | 107.22 | NumAromaticRings: | 2 |
