Glycoside
GD092201
Name:
NoneFormula:
C15H16O7N3BrSmiles:
O=[N+]([O-])c1cnc2cc(Br)ccc2c1N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Nc1c([N+](=O)[O-])cnc2cc(Br)ccc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.4 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 4 |
| MolWt: | 430.21 | Num_heavy_atoms: | 26 |
| TPSA: | 158.21 | NumAromaticRings: | 2 |
Unique Aglycone
AD40244
Formula: C9H6O2N3Br
Smiles:
Nc1c([N+](=O)[O-])cnc2cc(Br)ccc12| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 2.49 | Num_rotatable_bonds: | 1 |
| MolWt: | 268.07 | Num_heavy_atoms: | 15 |
| TPSA: | 82.05 | NumAromaticRings: | 2 |
