Glycoside
GD075928
Name:
NoneFormula:
C11H20O8N3BrSmiles:
O=[N+]([O-])C1CC(Br)N(O)C(N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)C1Aglycone:
NC1CC([N+](=O)[O-])CC(Br)N1OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -2.45 | Num_rotatable_bonds: | 4 |
| MolWt: | 402.2 | Num_heavy_atoms: | 23 |
| TPSA: | 168.79 | NumAromaticRings: | 0 |
Unique Aglycone
AD35140
Formula: C5H10O3N3Br
Smiles:
NC1CC([N+](=O)[O-])CC(Br)N1O| HBA: | 6 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.12 | Num_rotatable_bonds: | 1 |
| MolWt: | 240.06 | Num_heavy_atoms: | 12 |
| TPSA: | 92.63 | NumAromaticRings: | 0 |
