Glycoside
GD005939
Name:
NoneFormula:
C21H19O4NFClSmiles:
O[C@@H]1[C@@H](n2cc(Cc3ccc(F)cc3)c3c(Cl)cccc32)OC[C@@H](O)[C@H]1OAglycone:
Fc1ccc(Cc2c[nH]c3cccc(Cl)c23)cc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 4 |
| HBD: | 3 | FractionCSP3: | 0.3 |
| AlogP: | 2.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 391.83 | Num_heavy_atoms: | 27 |
| TPSA: | 74.85 | NumAromaticRings: | 3 |
Unique Aglycone
AD04968
Formula: C16H11NFCl
Smiles:
Fc1ccc(Cc2c[nH]c3cccc(Cl)c23)cc1| HBA: | 1 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.07 |
| AlogP: | 4.55 | Num_rotatable_bonds: | 2 |
| MolWt: | 259.71 | Num_heavy_atoms: | 18 |
| TPSA: | 15.79 | NumAromaticRings: | 3 |
