Glycoside
GD068734
Name:
NoneFormula:
C13H19O5N2BrSmiles:
Cc1cc(C)c(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)nc1BrAglycone:
Cc1cc(C)c(Br)nc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.62 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 3 |
| MolWt: | 363.21 | Num_heavy_atoms: | 21 |
| TPSA: | 115.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD32577
Formula: C7H9N2Br
Smiles:
Cc1cc(C)c(Br)nc1N| HBA: | 2 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.29 |
| AlogP: | 2.04 | Num_rotatable_bonds: | 0 |
| MolWt: | 201.07 | Num_heavy_atoms: | 10 |
| TPSA: | 38.91 | NumAromaticRings: | 1 |
