Glycoside
GD014000
Name:
NoneFormula:
C19H21O7N2F3Smiles:
CCc1ccc(Cc2c(C(F)(F)F)n[nH]c2O[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)cc1Aglycone:
CCc1ccc(Cc2c(C(F)(F)F)n[nH]c2O)cc1Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | 0.85 | Num_rotatable_bonds: | 6 |
| MolWt: | 446.38 | Num_heavy_atoms: | 31 |
| TPSA: | 145.13 | NumAromaticRings: | 2 |
Unique Aglycone
AD10372
Formula: C13H13ON2F3
Smiles:
CCc1ccc(Cc2c(C(F)(F)F)n[nH]c2O)cc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.31 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.25 | Num_heavy_atoms: | 19 |
| TPSA: | 48.91 | NumAromaticRings: | 2 |
