Glycoside
GD033161
Name:
NoneFormula:
C18H22O6N3FSmiles:
CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](OCc2cc(-c3cccc(F)c3)nc(N)n2)[C@H]1OAglycone:
Nc1nc(CO)cc(-c2cccc(F)c2)n1Sugarmoiety:
COC1OC(CO)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 6 |
| MolWt: | 395.39 | Num_heavy_atoms: | 28 |
| TPSA: | 140.18 | NumAromaticRings: | 2 |
Unique Aglycone
AD21188
Formula: C11H10ON3F
Smiles:
Nc1nc(CO)cc(-c2cccc(F)c2)n1| HBA: | 4 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.09 |
| AlogP: | 1.36 | Num_rotatable_bonds: | 2 |
| MolWt: | 219.22 | Num_heavy_atoms: | 16 |
| TPSA: | 72.03 | NumAromaticRings: | 2 |
