Glycoside
GD029351
Name:
NoneFormula:
C22H28O12N2F4Smiles:
COc1c(F)c(F)c(C(=O)N[C@@H]2[C@H](O)[C@H](O[C@@H]3[C@H](CO)OC(O)[C@H](NC(C)=O)[C@H]3O)O[C@H](CO)[C@H]2O)c(F)c1FAglycone:
COc1c(F)c(F)c(C(N)=O)c(F)c1FSugarmoiety:
CC(=O)NC1C(O)OC(CO)C(OC2OC(CO)C(O)C(O)C2O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 3 |
| HBD: | 8 | FractionCSP3: | 0.64 |
| AlogP: | -3.25 | Num_rotatable_bonds: | 8 |
| MolWt: | 588.46 | Num_heavy_atoms: | 40 |
| TPSA: | 216.5 | NumAromaticRings: | 1 |
Unique Aglycone
AD19095
Formula: C8H5O2NF4
Smiles:
COc1c(F)c(F)c(C(N)=O)c(F)c1F| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 223.12 | Num_heavy_atoms: | 15 |
| TPSA: | 52.32 | NumAromaticRings: | 1 |
