Glycoside
GD057845
Name:
NoneFormula:
C16H31O6N2Smiles:
CC[NH+](CC)[C@H]1CC[C@@H](NC(=O)C(=O)[C@H](O)[C@H](O)[C@@H](O)CO)CC1Aglycone:
CC[NH+](CC)C1CCC(N)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -3.02 | Num_rotatable_bonds: | 9 |
| MolWt: | 347.43 | Num_heavy_atoms: | 24 |
| TPSA: | 131.53 | 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 |
