Glycoside
GD109142
Name:
NoneFormula:
C24H24O8NBrSmiles:
COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1O[C@@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]1OAglycone:
COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.29 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 6 |
| MolWt: | 534.36 | Num_heavy_atoms: | 34 |
| TPSA: | 137.71 | NumAromaticRings: | 3 |
Unique Aglycone
AD44509
Formula: C18H14O3NBr
Smiles:
COc1ccccc1NC(=O)c1cc2cc(Br)ccc2cc1O| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.06 |
| AlogP: | 4.57 | Num_rotatable_bonds: | 3 |
| MolWt: | 372.22 | Num_heavy_atoms: | 23 |
| TPSA: | 58.56 | NumAromaticRings: | 3 |
