Glycoside
GD083708
Name:
NoneFormula:
C18H22O7NF3Smiles:
O=C(NC1(c2ccccc2C(F)(F)F)CCOCC1)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
NC1(c2ccccc2C(F)(F)F)CCOCC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -0.53 | Num_rotatable_bonds: | 7 |
| MolWt: | 421.37 | Num_heavy_atoms: | 29 |
| TPSA: | 136.32 | NumAromaticRings: | 1 |
Unique Aglycone
AD37316
Formula: C12H14ONF3
Smiles:
NC1(c2ccccc2C(F)(F)F)CCOCC1| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 2.67 | Num_rotatable_bonds: | 1 |
| MolWt: | 245.24 | Num_heavy_atoms: | 17 |
| TPSA: | 35.25 | NumAromaticRings: | 1 |
