Glycoside
GD050227
Name:
NoneFormula:
C14H27O6N2Smiles:
CCC[NH+]1CCC(NC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)CC1Aglycone:
CCC[NH+]1CCC(N)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.86 |
| AlogP: | -3.8 | Num_rotatable_bonds: | 8 |
| MolWt: | 319.38 | Num_heavy_atoms: | 22 |
| TPSA: | 131.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD26555
Formula: C8H19N2
Smiles:
CCC[NH+]1CCC(N)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | -0.6 | Num_rotatable_bonds: | 2 |
| MolWt: | 143.25 | Num_heavy_atoms: | 10 |
| TPSA: | 30.46 | NumAromaticRings: | 0 |
