Glycoside
GD122736
Name:
Lemnaloside DFormula:
C26H42O7Smiles:
C=C(C)C(=O)CCC(C)C1CCC(C)(OC2OC(CO)C(O)C(O)C2O)C2CCC(C)=CC12Aglycone:
C=C(C)C(=O)CCC(C)C1CCC(C)(O)C2CCC(C)=CC12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | 2.51 | Num_rotatable_bonds: | 8 |
| MolWt: | 466.62 | Num_heavy_atoms: | 33 |
| TPSA: | 116.45 | NumAromaticRings: | 0 |
Unique Aglycone
AD49488
Formula: C20H32O2
Smiles:
C=C(C)C(=O)CCC(C)C1CCC(C)(O)C2CCC(C)=CC12| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.75 |
| AlogP: | 4.68 | Num_rotatable_bonds: | 5 |
| MolWt: | 304.47 | Num_heavy_atoms: | 22 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
