Glycoside
GD092470
Name:
NoneFormula:
C17H18O6N2ClBrSmiles:
CC(=O)N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O[C@@H]1Oc1c[nH]c2ccc(Br)c(Cl)c12Aglycone:
Oc1c[nH]c2ccc(Br)c(Cl)c12Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.44 |
| AlogP: | 0.91 | Num_rotatable_bonds: | 4 |
| MolWt: | 449.69 | Num_heavy_atoms: | 26 |
| TPSA: | 124.04 | NumAromaticRings: | 2 |
Unique Aglycone
AD08346
Formula: C9H5ONClBr
Smiles:
Oc1c[nH]c2ccc(Br)c(Cl)c12| HBA: | 2 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 3.29 | Num_rotatable_bonds: | 0 |
| MolWt: | 246.49 | Num_heavy_atoms: | 12 |
| TPSA: | 36.02 | NumAromaticRings: | 2 |
