Glycoside
GD074642
Name:
NoneFormula:
C17H21O7N2FSmiles:
C[C@@]1(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)CC(c2ccc(F)cc2)=NO1Aglycone:
CC1(C(N)=O)CC(c2ccc(F)cc2)=NO1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.38 | Num_rotatable_bonds: | 4 |
| MolWt: | 384.36 | Num_heavy_atoms: | 27 |
| TPSA: | 140.84 | NumAromaticRings: | 1 |
Unique Aglycone
AD34510
Formula: C11H11O2N2F
Smiles:
CC1(C(N)=O)CC(c2ccc(F)cc2)=NO1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.27 |
| AlogP: | 1.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 222.22 | Num_heavy_atoms: | 16 |
| TPSA: | 64.68 | NumAromaticRings: | 1 |
