Glycoside
GD073519
Name:
NoneFormula:
C18H27O7N3Smiles:
CCN1C(=O)[C@]2(CC[C@@H]3CN(C(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)C[C@@H]32)N=C1CAglycone:
CCN1C(=O)C2(CCC3CNCC32)N=C1CSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.78 |
| AlogP: | -2.48 | Num_rotatable_bonds: | 6 |
| MolWt: | 397.43 | Num_heavy_atoms: | 28 |
| TPSA: | 150.97 | NumAromaticRings: | 0 |
Unique Aglycone
AD34065
Formula: C12H19ON3
Smiles:
CCN1C(=O)C2(CCC3CNCC32)N=C1C| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.83 |
| AlogP: | 0.64 | Num_rotatable_bonds: | 1 |
| MolWt: | 221.3 | Num_heavy_atoms: | 16 |
| TPSA: | 44.7 | NumAromaticRings: | 0 |
