Glycoside
GD025712
Name:
NoneFormula:
C17H14O4NCl3Smiles:
Cc1c(Cl)n(C2O[C@H](CO)[C@H](O)[C@H]2O)c2cc(Cl)c(Cl)cc12Aglycone:
Cc1c(Cl)[nH]c2cc(Cl)c(Cl)cc12Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 5 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.43 |
| AlogP: | 2.52 | Num_rotatable_bonds: | 2 |
| MolWt: | 366.63 | Num_heavy_atoms: | 22 |
| TPSA: | 74.85 | NumAromaticRings: | 2 |
Unique Aglycone
AD17017
Formula: C12H6NCl3
Smiles:
Cc1c(Cl)[nH]c2cc(Cl)c(Cl)cc12| HBA: | 1 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 4.44 | Num_rotatable_bonds: | 0 |
| MolWt: | 234.51 | Num_heavy_atoms: | 13 |
| TPSA: | 15.79 | NumAromaticRings: | 2 |
