Glycoside
GD123694
Name:
SecologanolFormula:
C17H26O10Smiles:
C=CC1C(OC2OC(CO)C(O)C(O)C2O)OC=C(C(=O)OC)C1CCOAglycone:
C=CC1C(O)OC=C(C(=O)OC)C1CCOSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.71 |
| AlogP: | -1.98 | Num_rotatable_bonds: | 7 |
| MolWt: | 390.39 | Num_heavy_atoms: | 27 |
| TPSA: | 155.14 | NumAromaticRings: | 0 |
Unique Aglycone
AD49942
Formula: C11H16O5
Smiles:
C=CC1C(O)OC=C(C(=O)OC)C1CCO| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.55 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 4 |
| MolWt: | 228.24 | Num_heavy_atoms: | 16 |
| TPSA: | 75.99 | NumAromaticRings: | 0 |
