Glycoside
GD007815
Name:
NoneFormula:
C21H20O5NClSmiles:
Oc1ccc(Cc2cn([C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)c3cccc(Cl)c23)cc1Aglycone:
Oc1ccc(Cc2c[nH]c3cccc(Cl)c23)cc1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 6 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.3 |
| AlogP: | 2.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 389.84 | Num_heavy_atoms: | 27 |
| TPSA: | 95.08 | NumAromaticRings: | 3 |
Unique Aglycone
AD06326
Formula: C16H12ONCl
Smiles:
Oc1ccc(Cc2c[nH]c3cccc(Cl)c23)cc1| HBA: | 2 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 4.12 | Num_rotatable_bonds: | 2 |
| MolWt: | 257.72 | Num_heavy_atoms: | 18 |
| TPSA: | 36.02 | NumAromaticRings: | 3 |
