Glycoside
GD070898
Name:
NoneFormula:
C14H16O7N3F3Smiles:
O=C(NC/C=C/c1cn([C@@H]2O[C@H](CO)[C@@H](O)[C@H]2O)c(=O)[nH]c1=O)C(F)(F)FAglycone:
O=C(NCC=Cc1c[nH]c(=O)[nH]c1=O)C(F)(F)FSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | -2.16 | Num_rotatable_bonds: | 5 |
| MolWt: | 395.29 | Num_heavy_atoms: | 27 |
| TPSA: | 153.88 | NumAromaticRings: | 1 |
Unique Aglycone
AD33526
Formula: C9H8O3N3F3
Smiles:
O=C(NCC=Cc1c[nH]c(=O)[nH]c1=O)C(F)(F)F| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.22 |
| AlogP: | -0.25 | Num_rotatable_bonds: | 3 |
| MolWt: | 263.17 | Num_heavy_atoms: | 18 |
| TPSA: | 94.82 | NumAromaticRings: | 1 |
