Glycoside
GD050697
Name:
NoneFormula:
C15H29O5N2Smiles:
C[N@H+]1[C@H]2CCC[C@@H]1C[C@@H](N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)C2Aglycone:
C[NH+]1C2CCCC1CC(N)C2Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.93 |
| AlogP: | -3.18 | Num_rotatable_bonds: | 7 |
| MolWt: | 317.41 | Num_heavy_atoms: | 22 |
| TPSA: | 114.46 | NumAromaticRings: | 0 |
Unique Aglycone
AD25565
Formula: C9H19N2
Smiles:
C[NH+]1C2CCCC1CC(N)C2| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.46 | Num_rotatable_bonds: | 0 |
| MolWt: | 155.26 | Num_heavy_atoms: | 11 |
| TPSA: | 30.46 | NumAromaticRings: | 0 |
