Glycoside
GD131347
Name:
Eleganoside AFormula:
C20H32O13Smiles:
COC(=O)C1=COC(OC2OC(CO)C(O)C(O)C2O)C2C1(O)CC(OCC(C)O)C2(C)OAglycone:
COC(=O)C1=COC(O)C2C1(O)CC(OCC(C)O)C2(C)OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 13 | RingCount: | 3 |
| HBD: | 7 | FractionCSP3: | 0.85 |
| AlogP: | -3.52 | Num_rotatable_bonds: | 7 |
| MolWt: | 480.46 | Num_heavy_atoms: | 33 |
| TPSA: | 204.83 | NumAromaticRings: | 0 |
Unique Aglycone
AD53217
Formula: C14H22O8
Smiles:
COC(=O)C1=COC(O)C2C1(O)CC(OCC(C)O)C2(C)O| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.79 |
| AlogP: | -1.34 | Num_rotatable_bonds: | 4 |
| MolWt: | 318.32 | Num_heavy_atoms: | 22 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
