Glycoside
GD050535
Name:
NoneFormula:
C12H23O7N2Smiles:
O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)C1Aglycone:
[NH3+]C1CCC(C[N+](=O)[O-])C1Sugarmoiety:
OCC1OC(O)C([OH2+])C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 1.0 |
| AlogP: | -3.2 | Num_rotatable_bonds: | 5 |
| MolWt: | 307.32 | Num_heavy_atoms: | 21 |
| TPSA: | 149.9 | NumAromaticRings: | 0 |
Unique Aglycone
AD26647
Formula: C6H13O2N2
Smiles:
[NH3+]C1CCC(C[N+](=O)[O-])C1| HBA: | 4 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 145.18 | Num_heavy_atoms: | 10 |
| TPSA: | 70.78 | NumAromaticRings: | 0 |
