Glycoside
GD100928
Name:
NoneFormula:
C15H19O6NBr2Smiles:
O=C(CCc1cc(Br)cc(Br)c1)N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
NC(=O)CCc1cc(Br)cc(Br)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | 0.06 | Num_rotatable_bonds: | 5 |
| MolWt: | 469.13 | Num_heavy_atoms: | 24 |
| TPSA: | 119.25 | NumAromaticRings: | 1 |
Unique Aglycone
AD42648
Formula: C9H9ONBr2
Smiles:
NC(=O)CCc1cc(Br)cc(Br)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 2.63 | Num_rotatable_bonds: | 3 |
| MolWt: | 306.99 | Num_heavy_atoms: | 13 |
| TPSA: | 43.09 | NumAromaticRings: | 1 |
