Glycoside
GD141806
Name:
BrasosideFormula:
C16H22O9Smiles:
CC1CC2OC(=O)C3=COC(OC4OC(CO)C(O)C(O)C4O)C1C32Aglycone:
CC1CC2OC(=O)C3=COC(O)C1C32Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.81 |
| AlogP: | -1.76 | Num_rotatable_bonds: | 3 |
| MolWt: | 358.34 | Num_heavy_atoms: | 25 |
| TPSA: | 134.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD57098
Formula: C10H12O4
Smiles:
CC1CC2OC(=O)C3=COC(O)C1C32| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.7 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 0 |
| MolWt: | 196.2 | Num_heavy_atoms: | 14 |
| TPSA: | 55.76 | NumAromaticRings: | 0 |
