Glycoside
GD122725
Name:
Ascleposide EFormula:
C19H32O8Smiles:
CC(=O)CCC1C2(C)COC1(C)CC(OC1OC(CO)C(O)C(O)C1O)C2Aglycone:
CC(=O)CCC1C2(C)COC1(C)CC(O)C2Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.95 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 6 |
| MolWt: | 388.46 | Num_heavy_atoms: | 27 |
| TPSA: | 125.68 | NumAromaticRings: | 0 |
Unique Aglycone
AD49480
Formula: C13H22O3
Smiles:
CC(=O)CCC1C2(C)COC1(C)CC(O)C2| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.92 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 3 |
| MolWt: | 226.32 | Num_heavy_atoms: | 16 |
| TPSA: | 46.53 | NumAromaticRings: | 0 |
