Glycoside
GD086558
Name:
NoneFormula:
C19H33O8N3Smiles:
CC(C)(C)OC(=O)N1CCN2C[C@@H](CNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)C[C@H]2C1Aglycone:
CC(C)(C)OC(=O)N1CCN2CC(CN)CC2C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.84 |
| AlogP: | -2.31 | Num_rotatable_bonds: | 7 |
| MolWt: | 431.49 | Num_heavy_atoms: | 30 |
| TPSA: | 159.87 | NumAromaticRings: | 0 |
Unique Aglycone
AD38313
Formula: C13H25O2N3
Smiles:
CC(C)(C)OC(=O)N1CCN2CC(CN)CC2C1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.92 |
| AlogP: | 0.89 | Num_rotatable_bonds: | 1 |
| MolWt: | 255.36 | Num_heavy_atoms: | 18 |
| TPSA: | 58.8 | NumAromaticRings: | 0 |
