Glycoside
GD106703
Name:
NoneFormula:
C19H22O7N7BrSmiles:
COc1cc(Br)c(C/N=N/c2nc3c(=O)[nH]c(N)nc3n2[C@H]2O[C@@H](CO)[C@@H](O)[C@@H]2O)cc1OCAglycone:
COc1cc(Br)c(CN=NC2=Nc3c(nc(N)[nH]c3=O)[N]2)cc1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 14 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.42 |
| AlogP: | 0.38 | Num_rotatable_bonds: | 7 |
| MolWt: | 540.33 | Num_heavy_atoms: | 34 |
| TPSA: | 202.69 | NumAromaticRings: | 3 |
Unique Aglycone
AD44204
Formula: C14H13O3N7Br
Smiles:
COc1cc(Br)c(CN=NC2=Nc3c(nc(N)[nH]c3=O)[N]2)cc1OC| HBA: | 10 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.21 |
| AlogP: | 2.02 | Num_rotatable_bonds: | 4 |
| MolWt: | 407.21 | Num_heavy_atoms: | 25 |
| TPSA: | 141.41 | NumAromaticRings: | 2 |
