Glycoside
GD062709
Name:
NoneFormula:
C11H16O6N3BrSmiles:
COc1nc(N[C@@H]2OC[C@@H](O)[C@@H](O)[C@@H]2O)c(Br)c(=O)n1CAglycone:
COc1nc(N)c(Br)c(=O)n1CSugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.64 |
| AlogP: | -1.6 | Num_rotatable_bonds: | 3 |
| MolWt: | 366.17 | Num_heavy_atoms: | 21 |
| TPSA: | 126.07 | NumAromaticRings: | 1 |
Unique Aglycone
AD30361
Formula: C6H8O2N3Br
Smiles:
COc1nc(N)c(Br)c(=O)n1C| HBA: | 5 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 0.13 | Num_rotatable_bonds: | 1 |
| MolWt: | 234.05 | Num_heavy_atoms: | 12 |
| TPSA: | 70.14 | NumAromaticRings: | 1 |
