Glycoside
GD139855
Name:
2-[2,6-dihydroxy-4-(hydroxymethyl)phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triolFormula:
C13H18O9Smiles:
OCc1cc(O)c(OC2OC(CO)C(O)C(O)C2O)c(O)c1Aglycone:
OCc1cc(O)c(O)c(O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 7 | FractionCSP3: | 0.54 |
| AlogP: | -2.23 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.28 | Num_heavy_atoms: | 22 |
| TPSA: | 160.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD46373
Formula: C7H8O4
Smiles:
OCc1cc(O)c(O)c(O)c1| HBA: | 4 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.14 |
| AlogP: | 0.3 | Num_rotatable_bonds: | 1 |
| MolWt: | 156.14 | Num_heavy_atoms: | 11 |
| TPSA: | 80.92 | NumAromaticRings: | 1 |
