Glycoside
GD081036
Name:
NoneFormula:
C17H28O7N4Smiles:
CC(C)(C)OC(=O)N1CC[C@H](c2cn(C[C@H]3O[C@H](O)[C@H](O)[C@@H](O)[C@H]3O)nn2)C1Aglycone:
Cn1cc(C2CCN(C(=O)OC(C)(C)C)C2)nn1Sugarmoiety:
OC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.82 |
| AlogP: | -1.2 | Num_rotatable_bonds: | 3 |
| MolWt: | 400.43 | Num_heavy_atoms: | 28 |
| TPSA: | 150.4 | NumAromaticRings: | 1 |
Unique Aglycone
AD36552
Formula: C12H20O2N4
Smiles:
Cn1cc(C2CCN(C(=O)OC(C)(C)C)C2)nn1| HBA: | 6 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.75 |
| AlogP: | 1.54 | Num_rotatable_bonds: | 1 |
| MolWt: | 252.32 | Num_heavy_atoms: | 18 |
| TPSA: | 60.25 | NumAromaticRings: | 1 |
