Glycoside
GD058417
Name:
NoneFormula:
C16H33O5N2Smiles:
CC[NH+](CC)[C@H]1CC[C@@H](N[C@@H](C=O)[C@@H](O)[C@H](O)[C@H](O)CO)CC1Aglycone:
CC[NH+](CC)C1CCC(N)CC1Sugarmoiety:
O=CC(O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.94 |
| AlogP: | -2.55 | Num_rotatable_bonds: | 10 |
| MolWt: | 333.45 | Num_heavy_atoms: | 23 |
| TPSA: | 114.46 | NumAromaticRings: | 0 |
Unique Aglycone
AD29019
Formula: C10H23N2
Smiles:
CC[NH+](CC)C1CCC(N)CC1| HBA: | 2 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 3 |
| MolWt: | 171.31 | Num_heavy_atoms: | 12 |
| TPSA: | 30.46 | NumAromaticRings: | 0 |
