Glycoside
GD146510
Name:
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl 3,4-dimethoxybenzoateFormula:
C15H20O9Smiles:
COc1ccc(C(=O)OC2OC(CO)C(O)C(O)C2O)cc1OCAglycone:
COc1ccc(C(=O)O)cc1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.53 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 5 |
| MolWt: | 344.32 | Num_heavy_atoms: | 24 |
| TPSA: | 134.91 | NumAromaticRings: | 1 |
Unique Aglycone
AD04892
Formula: C9H10O4
Smiles:
COc1ccc(C(=O)O)cc1OC| HBA: | 4 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 1.4 | Num_rotatable_bonds: | 3 |
| MolWt: | 182.17 | Num_heavy_atoms: | 13 |
| TPSA: | 55.76 | NumAromaticRings: | 1 |
