Glycoside
GD081659
Name:
NoneFormula:
C18H30O9N2Smiles:
CC(C)(C)OC(=O)N1C[C@H]2C[C@H](CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)O[C@H]2C1Aglycone:
CC(C)(C)OC(=O)N1CC2CC(CN)OC2C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.83 |
| AlogP: | -2.23 | Num_rotatable_bonds: | 7 |
| MolWt: | 418.44 | Num_heavy_atoms: | 29 |
| TPSA: | 165.86 | NumAromaticRings: | 0 |
Unique Aglycone
AD36732
Formula: C12H22O3N2
Smiles:
CC(C)(C)OC(=O)N1CC2CC(CN)OC2C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.92 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 1 |
| MolWt: | 242.32 | Num_heavy_atoms: | 17 |
| TPSA: | 64.79 | NumAromaticRings: | 0 |
