Glycoside
GD028502
Name:
NoneFormula:
C21H24O7N2FBrSmiles:
CO[C@@H]1O[C@H](CNC(=O)c2cc(Br)c(C)n(Cc3ccc(F)cc3)c2=O)[C@H](O)[C@H](O)[C@H]1OAglycone:
CNC(=O)c1cc(Br)c(C)n(Cc2ccc(F)cc2)c1=OSugarmoiety:
COC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.43 |
| AlogP: | 0.29 | Num_rotatable_bonds: | 6 |
| MolWt: | 515.33 | Num_heavy_atoms: | 32 |
| TPSA: | 130.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD18609
Formula: C15H14O2N2FBr
Smiles:
CNC(=O)c1cc(Br)c(C)n(Cc2ccc(F)cc2)c1=O| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.2 |
| AlogP: | 2.47 | Num_rotatable_bonds: | 3 |
| MolWt: | 353.19 | Num_heavy_atoms: | 21 |
| TPSA: | 51.1 | NumAromaticRings: | 2 |
