Glycoside
GD070492
Name:
NoneFormula:
C19H31O5N2Smiles:
Cc1ccc(C[NH+]2CCCCC2)cc1N[C@H]1[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
Cc1ccc(C[NH+]2CCCCC2)cc1NSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.68 |
| AlogP: | -1.22 | Num_rotatable_bonds: | 5 |
| MolWt: | 367.47 | Num_heavy_atoms: | 26 |
| TPSA: | 106.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD33418
Formula: C13H21N2
Smiles:
Cc1ccc(C[NH+]2CCCCC2)cc1N| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.54 |
| AlogP: | 1.15 | Num_rotatable_bonds: | 2 |
| MolWt: | 205.32 | Num_heavy_atoms: | 15 |
| TPSA: | 30.46 | NumAromaticRings: | 1 |
