Glycoside
GD070518
Name:
NoneFormula:
C18H30O6NSmiles:
COc1ccccc1C[C@@H](C)[NH2+]CCO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1OAglycone:
COc1ccccc1CC(C)[NH2+]CCOSugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.67 |
| AlogP: | -0.97 | Num_rotatable_bonds: | 8 |
| MolWt: | 356.44 | Num_heavy_atoms: | 25 |
| TPSA: | 104.99 | NumAromaticRings: | 1 |
Unique Aglycone
AD33429
Formula: C12H20O2N
Smiles:
COc1ccccc1CC(C)[NH2+]CCO| HBA: | 3 | RingCount: | 1 |
| HBD: | 3 | FractionCSP3: | 0.5 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 6 |
| MolWt: | 210.3 | Num_heavy_atoms: | 15 |
| TPSA: | 46.07 | NumAromaticRings: | 1 |
