Glycoside
GD101900
Name:
NoneFormula:
C23H25O8NFClSmiles:
COc1cc(OC)c(C(=O)N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1Cc1cccc(Cl)c1FAglycone:
COc1cc(OC)c(C(N)=O)cc1Cc1cccc(Cl)c1FSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.62 | Num_rotatable_bonds: | 7 |
| MolWt: | 485.89 | Num_heavy_atoms: | 33 |
| TPSA: | 137.71 | NumAromaticRings: | 2 |
Unique Aglycone
AD43143
Formula: C17H15O3NFCl
Smiles:
COc1cc(OC)c(C(N)=O)cc1Cc1cccc(Cl)c1F| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.19 |
| AlogP: | 3.19 | Num_rotatable_bonds: | 5 |
| MolWt: | 323.75 | Num_heavy_atoms: | 22 |
| TPSA: | 61.55 | NumAromaticRings: | 2 |
