Glycoside
GD100947
Name:
NoneFormula:
C16H19O7NF3BrSmiles:
C[C@@H]1O[C@@H](OCCNC(=O)c2ccc(Br)cc2OC(F)(F)F)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
O=C(NCCO)c1ccc(Br)cc1OC(F)(F)FSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.56 |
| AlogP: | 0.92 | Num_rotatable_bonds: | 6 |
| MolWt: | 474.23 | Num_heavy_atoms: | 28 |
| TPSA: | 117.48 | NumAromaticRings: | 1 |
Unique Aglycone
AD42661
Formula: C10H9O3NF3Br
Smiles:
O=C(NCCO)c1ccc(Br)cc1OC(F)(F)F| HBA: | 4 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.3 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 328.08 | Num_heavy_atoms: | 18 |
| TPSA: | 58.56 | NumAromaticRings: | 1 |