Glycoside
GD135725
Name:
NoneFormula:
C21H36O9Smiles:
CC1(C)CCC(OC2OC(CO)C(O)C(O)C2O)C2(C)C1C(=O)CC(C)(O)C2COAglycone:
CC1(C)CCC(O)C2(C)C1C(=O)CC(C)(O)C2COSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.95 |
| AlogP: | -1.05 | Num_rotatable_bonds: | 4 |
| MolWt: | 432.51 | Num_heavy_atoms: | 30 |
| TPSA: | 156.91 | NumAromaticRings: | 0 |
Unique Aglycone
AD54877
Formula: C15H26O4
Smiles:
CC1(C)CCC(O)C2(C)C1C(=O)CC(C)(O)C2CO| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.93 |
| AlogP: | 1.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 270.37 | Num_heavy_atoms: | 19 |
| TPSA: | 77.76 | NumAromaticRings: | 0 |
