Glycoside
GD156868
Name:
bis({2,4-dihydroxy-3-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl})ethane-1,2-dioneFormula:
C26H30O16Smiles:
O=C(C(=O)c1ccc(O)c(C2OC(CO)C(O)C(O)C2O)c1O)c1ccc(O)c(C2OC(CO)C(O)C(O)C2O)c1OAglycone:
O=C(C(=O)c1ccc(O)cc1O)c1ccc(O)cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1O.OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 16 | RingCount: | 4 |
| HBD: | 12 | FractionCSP3: | 0.46 |
| AlogP: | -3.4 | Num_rotatable_bonds: | 7 |
| MolWt: | 598.51 | Num_heavy_atoms: | 42 |
| TPSA: | 295.36 | NumAromaticRings: | 2 |
Unique Aglycone
AD62070
Formula: C14H10O6
Smiles:
O=C(C(=O)c1ccc(O)cc1O)c1ccc(O)cc1O| HBA: | 6 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.0 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 274.23 | Num_heavy_atoms: | 20 |
| TPSA: | 115.06 | NumAromaticRings: | 2 |
