Glycoside
GD072619
Name:
NoneFormula:
C14H16O7NBrSmiles:
O=C(NCC(=O)c1cccc(Br)c1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
NCC(=O)c1cccc(Br)c1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.36 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 8 |
| MolWt: | 390.19 | Num_heavy_atoms: | 23 |
| TPSA: | 144.16 | NumAromaticRings: | 1 |
Unique Aglycone
AD33838
Formula: C8H8ONBr
Smiles:
NCC(=O)c1cccc(Br)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.59 | Num_rotatable_bonds: | 2 |
| MolWt: | 214.06 | Num_heavy_atoms: | 11 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
