Glycoside
GD013796
Name:
NoneFormula:
C18H28O8Smiles:
COc1ccc(COCC[C@H](C)OC2OC(CO)C(O)C(O)C2O)cc1Aglycone:
COc1ccc(COCCC(C)O)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 9 |
| MolWt: | 372.41 | Num_heavy_atoms: | 26 |
| TPSA: | 117.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD10239
Formula: C12H18O3
Smiles:
COc1ccc(COCCC(C)O)cc1| HBA: | 3 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 0.5 |
| AlogP: | 1.98 | Num_rotatable_bonds: | 6 |
| MolWt: | 210.27 | Num_heavy_atoms: | 15 |
| TPSA: | 38.69 | NumAromaticRings: | 1 |
