Glycoside
GD053424
Name:
NoneFormula:
C12H13O6N2F3Smiles:
O=C(/N=c1\cc[nH]cc1C(F)(F)F)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
N=c1cc[nH]cc1C(F)(F)FSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.42 |
| AlogP: | -1.9 | Num_rotatable_bonds: | 5 |
| MolWt: | 338.24 | Num_heavy_atoms: | 23 |
| TPSA: | 143.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD27277
Formula: C6H5N2F3
Smiles:
N=c1cc[nH]cc1C(F)(F)F| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 0 |
| MolWt: | 162.11 | Num_heavy_atoms: | 11 |
| TPSA: | 39.64 | NumAromaticRings: | 1 |
