Glycoside
GD133465
Name:
5-(1,2-dihydroxyethyl)-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolane-2,4-dioneFormula:
C12H18O11Smiles:
O=C1OC(C(O)CO)C(=O)C1OC1OC(CO)C(O)C(O)C1OAglycone:
O=C1OC(C(O)CO)C(=O)C1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.83 |
| AlogP: | -4.98 | Num_rotatable_bonds: | 5 |
| MolWt: | 338.26 | Num_heavy_atoms: | 23 |
| TPSA: | 183.21 | NumAromaticRings: | 0 |
Unique Aglycone
AD54019
Formula: C6H8O6
Smiles:
O=C1OC(C(O)CO)C(=O)C1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.67 |
| AlogP: | -2.8 | Num_rotatable_bonds: | 2 |
| MolWt: | 176.12 | Num_heavy_atoms: | 12 |
| TPSA: | 104.06 | NumAromaticRings: | 0 |
