Glycoside
GD004649
Name:
NoneFormula:
C12H22O7N4Smiles:
CC(=O)N[C@@H]1[C@H](ON=[N+]([O-])N2CCCC2)O[C@H](CO)[C@H](O)[C@H]1OAglycone:
[O-][N+](=NO)N1CCCC1Sugarmoiety:
CC(=O)NC1C(O)OC(CO)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.92 |
| AlogP: | -2.16 | Num_rotatable_bonds: | 5 |
| MolWt: | 334.33 | Num_heavy_atoms: | 23 |
| TPSA: | 149.92 | NumAromaticRings: | 0 |
Unique Aglycone
AD04030
Formula: C4H9O2N3
Smiles:
[O-][N+](=NO)N1CCCC1| HBA: | 5 | RingCount: | 1 |
| HBD: | 1 | FractionCSP3: | 1.0 |
| AlogP: | 0.35 | Num_rotatable_bonds: | 1 |
| MolWt: | 131.13 | Num_heavy_atoms: | 9 |
| TPSA: | 61.9 | NumAromaticRings: | 0 |
