Glycoside
GD139846
Name:
2-{3-hydroxy-2-[4-(3-hydroxypropyl)-2,5-dimethoxyphenoxy]propoxy}-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C20H32O11Smiles:
COc1cc(OC(CO)COC2OC(CO)C(O)C(O)C2O)c(OC)cc1CCCOAglycone:
COc1cc(OC(CO)CO)c(OC)cc1CCCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.7 |
| AlogP: | -1.82 | Num_rotatable_bonds: | 12 |
| MolWt: | 448.47 | Num_heavy_atoms: | 31 |
| TPSA: | 167.53 | NumAromaticRings: | 1 |
Unique Aglycone
AD56400
Formula: C14H22O6
Smiles:
COc1cc(OC(CO)CO)c(OC)cc1CCCO| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.57 |
| AlogP: | 0.36 | Num_rotatable_bonds: | 9 |
| MolWt: | 286.32 | Num_heavy_atoms: | 20 |
| TPSA: | 88.38 | NumAromaticRings: | 1 |
