Glycoside
GD142612
Name:
1-(6-ethoxy-3,4,5-trihydroxyoxan-2-yl)methyl 4-methyl 2-hydroxybutanedioateFormula:
C13H22O10Smiles:
CCOC1OC(COC(=O)C(O)CC(=O)OC)C(O)C(O)C1OAglycone:
COC(=O)CC(O)C(=O)OCSugarmoiety:
CCOC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.85 |
| AlogP: | -2.7 | Num_rotatable_bonds: | 7 |
| MolWt: | 338.31 | Num_heavy_atoms: | 23 |
| TPSA: | 151.98 | NumAromaticRings: | 0 |
Unique Aglycone
AD57386
Formula: C6H10O5
Smiles:
COC(=O)CC(O)C(=O)OC| HBA: | 5 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | -0.92 | Num_rotatable_bonds: | 3 |
| MolWt: | 162.14 | Num_heavy_atoms: | 11 |
| TPSA: | 72.83 | NumAromaticRings: | 0 |
