Glycoside
GD060332
Name:
NoneFormula:
C12H17O5N2BrSmiles:
Cc1cnc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c(Br)c1Aglycone:
Cc1cnc(N)c(Br)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.58 |
| AlogP: | -0.64 | Num_rotatable_bonds: | 3 |
| MolWt: | 349.18 | Num_heavy_atoms: | 20 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD29817
Formula: C6H7N2Br
Smiles:
Cc1cnc(N)c(Br)c1| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 1.73 | Num_rotatable_bonds: | 0 |
| MolWt: | 187.04 | Num_heavy_atoms: | 9 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
