Glycoside
GD068048
Name:
NoneFormula:
C18H29O5N2Smiles:
C[C@@H]1C[C@H](N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)C[N@@H+]1Cc1ccccc1Aglycone:
CC1CC(N)C[NH+]1Cc1ccccc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.67 |
| AlogP: | -2.38 | Num_rotatable_bonds: | 5 |
| MolWt: | 353.44 | Num_heavy_atoms: | 25 |
| TPSA: | 106.62 | NumAromaticRings: | 1 |
Unique Aglycone
AD32119
Formula: C12H19N2
Smiles:
CC1CC(N)C[NH+]1Cc1ccccc1| HBA: | 2 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.19 | Num_rotatable_bonds: | 2 |
| MolWt: | 191.3 | Num_heavy_atoms: | 14 |
| TPSA: | 30.46 | NumAromaticRings: | 1 |
