Glycoside
GD090350
Name:
NoneFormula:
C13H12O8NF2BrSmiles:
O=C(Nc1cc2c(cc1Br)OC(F)(F)O2)C(=O)[C@H](O)[C@H](O)[C@@H](O)COAglycone:
Nc1cc2c(cc1Br)OC(F)(F)O2Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.38 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 6 |
| MolWt: | 428.14 | Num_heavy_atoms: | 25 |
| TPSA: | 145.55 | NumAromaticRings: | 1 |
Unique Aglycone
AD39326
Formula: C7H4O2NF2Br
Smiles:
Nc1cc2c(cc1Br)OC(F)(F)O2| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 2.35 | Num_rotatable_bonds: | 0 |
| MolWt: | 252.01 | Num_heavy_atoms: | 13 |
| TPSA: | 44.48 | NumAromaticRings: | 1 |
