Glycoside
GD069718
Name:
NoneFormula:
C17H26O5N2FSmiles:
OC[C@H]1O[C@H](O)[C@H](Nc2ccc(F)c(C[NH+]3CCCC3)c2)[C@@H](O)[C@@H]1OAglycone:
Nc1ccc(F)c(C[NH+]2CCCC2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | -1.78 | Num_rotatable_bonds: | 5 |
| MolWt: | 357.4 | Num_heavy_atoms: | 25 |
| TPSA: | 106.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD33050
Formula: C11H16N2F
Smiles:
Nc1ccc(F)c(C[NH+]2CCCC2)c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | 0.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 195.26 | Num_heavy_atoms: | 14 |
| TPSA: | 30.46 | NumAromaticRings: | 1 |
