Glycoside
GD053853
Name:
NoneFormula:
C17H27O5N2Smiles:
OC[C@H]1O[C@@H](O)[C@H](N[C@@H]2CC[N@H+](Cc3ccccc3)C2)[C@@H](O)[C@@H]1OAglycone:
NC1CC[NH+](Cc2ccccc2)C1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.65 |
| AlogP: | -2.77 | Num_rotatable_bonds: | 5 |
| MolWt: | 339.41 | Num_heavy_atoms: | 24 |
| TPSA: | 106.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD27444
Formula: C11H17N2
Smiles:
NC1CC[NH+](Cc2ccccc2)C1| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.45 |
| AlogP: | -0.2 | Num_rotatable_bonds: | 2 |
| MolWt: | 177.27 | Num_heavy_atoms: | 13 |
| TPSA: | 30.46 | NumAromaticRings: | 1 |
