Glycoside
GD119440
Name:
2-[3-hydroxy-2-(3-hydroxy-4,5-dimethoxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C17H26O10Smiles:
COc1cc(C(CO)COC2OC(CO)C(O)C(O)C2O)cc(O)c1OCAglycone:
COc1cc(C(CO)CO)cc(O)c1OCSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | -1.7 | Num_rotatable_bonds: | 8 |
| MolWt: | 390.39 | Num_heavy_atoms: | 27 |
| TPSA: | 158.3 | NumAromaticRings: | 1 |
Unique Aglycone
AD47850
Formula: C11H16O5
Smiles:
COc1cc(C(CO)CO)cc(O)c1OC| HBA: | 5 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 5 |
| MolWt: | 228.24 | Num_heavy_atoms: | 16 |
| TPSA: | 79.15 | NumAromaticRings: | 1 |
