Glycoside
GD013978
Name:
NoneFormula:
C11H12O4N3BrSmiles:
OC[C@@H]1OC(n2cc(Br)c3cncnc32)[C@H](O)[C@H]1OAglycone:
BrC1=C[N]c2ncncc21Sugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | -0.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 330.14 | Num_heavy_atoms: | 19 |
| TPSA: | 100.63 | NumAromaticRings: | 2 |
Unique Aglycone
AD10358
Formula: C6H3N3Br
Smiles:
BrC1=C[N]c2ncncc21| HBA: | 3 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.0 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 0 |
| MolWt: | 197.02 | Num_heavy_atoms: | 10 |
| TPSA: | 39.88 | NumAromaticRings: | 1 |
