Glycoside
GD007746
Name:
NoneFormula:
C11H13O5N4BrSmiles:
OC[C@@H]1O[C@H](n2cc(Br)c3c(NO)ncnc32)[C@H](O)[C@H]1OAglycone:
ONc1ncnc2c1C(Br)=C[N]2Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -0.39 | Num_rotatable_bonds: | 3 |
| MolWt: | 361.15 | Num_heavy_atoms: | 21 |
| TPSA: | 132.89 | NumAromaticRings: | 2 |
Unique Aglycone
AD06276
Formula: C6H4ON4Br
Smiles:
ONc1ncnc2c1C(Br)=C[N]2| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 1.22 | Num_rotatable_bonds: | 1 |
| MolWt: | 228.03 | Num_heavy_atoms: | 12 |
| TPSA: | 72.14 | NumAromaticRings: | 1 |
