Glycoside
GD116324
Name:
Ar-1C4972Formula:
C21H30O8Smiles:
CC1CCC2C(C(=O)OC3OC(C(=O)O)C(O)C(O)C3O)=CC3CC(C)(C)CC132Aglycone:
CC1CCC2C(C(=O)O)=CC3CC(C)(C)CC132Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | 0.83 | Num_rotatable_bonds: | 3 |
| MolWt: | 410.46 | Num_heavy_atoms: | 29 |
| TPSA: | 133.52 | NumAromaticRings: | 0 |
Unique Aglycone
AD46170
Formula: C15H22O2
Smiles:
CC1CCC2C(C(=O)O)=CC3CC(C)(C)CC132| HBA: | 2 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 3.48 | Num_rotatable_bonds: | 1 |
| MolWt: | 234.34 | Num_heavy_atoms: | 17 |
| TPSA: | 37.3 | NumAromaticRings: | 0 |
