Glycoside
GD088411
Name:
NoneFormula:
C18H29O9N3Smiles:
CC(C)(C)OC(=O)N1CC[C@]2(CC(C(=O)N[C@H]3[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)=NO2)C1Aglycone:
CC(C)(C)OC(=O)N1CCC2(CC(C(N)=O)=NO2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.83 |
| AlogP: | -1.94 | Num_rotatable_bonds: | 3 |
| MolWt: | 431.44 | Num_heavy_atoms: | 30 |
| TPSA: | 170.38 | NumAromaticRings: | 0 |
Unique Aglycone
AD38667
Formula: C12H19O4N3
Smiles:
CC(C)(C)OC(=O)N1CCC2(CC(C(N)=O)=NO2)C1| HBA: | 7 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.75 |
| AlogP: | 0.63 | Num_rotatable_bonds: | 1 |
| MolWt: | 269.3 | Num_heavy_atoms: | 19 |
| TPSA: | 94.22 | NumAromaticRings: | 0 |
