Glycoside
GD155156
Name:
Eriosemaside AFormula:
C26H34O13Smiles:
CC(C)=CCc1c(OC2OC(COC3OC(C)C(O)C(O)C3O)C(O)C(O)C2O)cc(O)c2c(=O)ccoc12Aglycone:
CC(C)=CCc1c(O)cc(O)c2c(=O)ccoc12Sugarmoiety:
CC1OC(OCC2OC(O)C(O)C(O)C2O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 4 |
| HBD: | 7 | FractionCSP3: | 0.58 |
| AlogP: | -0.96 | Num_rotatable_bonds: | 7 |
| MolWt: | 554.55 | Num_heavy_atoms: | 39 |
| TPSA: | 208.74 | NumAromaticRings: | 2 |
Unique Aglycone
AD61560
Formula: C14H14O4
Smiles:
CC(C)=CCc1c(O)cc(O)c2c(=O)ccoc12| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 2.71 | Num_rotatable_bonds: | 2 |
| MolWt: | 246.26 | Num_heavy_atoms: | 18 |
| TPSA: | 70.67 | NumAromaticRings: | 2 |
