Glycoside
GD063426
Name:
NoneFormula:
C17H31O6N2Smiles:
O=C(N[C@H]1CC[N@@H+](CC2CCCCC2)C1)C(=O)[C@H](O)[C@@H](O)[C@@H](O)COAglycone:
NC1CC[NH+](CC2CCCCC2)C1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.88 |
| AlogP: | -3.02 | Num_rotatable_bonds: | 8 |
| MolWt: | 359.44 | Num_heavy_atoms: | 25 |
| TPSA: | 131.53 | NumAromaticRings: | 0 |
Unique Aglycone
AD30551
Formula: C11H23N2
Smiles:
NC1CC[NH+](CC2CCCCC2)C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 1.0 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 2 |
| MolWt: | 183.32 | Num_heavy_atoms: | 13 |
| TPSA: | 30.46 | NumAromaticRings: | 0 |
