Glycoside
GD090703
Name:
NoneFormula:
C17H19O6N2BrSmiles:
Cc1ccc2cc(Br)cc(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c2n1Aglycone:
Cc1ccc2cc(Br)cc(C(N)=O)c2n1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | -0.16 | Num_rotatable_bonds: | 3 |
| MolWt: | 427.25 | Num_heavy_atoms: | 26 |
| TPSA: | 132.14 | NumAromaticRings: | 2 |
Unique Aglycone
AD39476
Formula: C11H9ON2Br
Smiles:
Cc1ccc2cc(Br)cc(C(N)=O)c2n1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.09 |
| AlogP: | 2.4 | Num_rotatable_bonds: | 1 |
| MolWt: | 265.11 | Num_heavy_atoms: | 15 |
| TPSA: | 55.98 | NumAromaticRings: | 2 |
