Glycoside
GD075736
Name:
NoneFormula:
C19H30O8NSmiles:
C[C@@H]1O[C@@H](OCC[NH2+]C[C@@](C)(O)C(=O)OCc2ccccc2)[C@@H](O)[C@H](O)[C@@H]1OAglycone:
CC(O)(C[NH2+]CCO)C(=O)OCc1ccccc1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 6 | FractionCSP3: | 0.63 |
| AlogP: | -2.11 | Num_rotatable_bonds: | 9 |
| MolWt: | 400.45 | Num_heavy_atoms: | 28 |
| TPSA: | 142.29 | NumAromaticRings: | 1 |
Unique Aglycone
AD35081
Formula: C13H20O4N
Smiles:
CC(O)(C[NH2+]CCO)C(=O)OCc1ccccc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 4 | FractionCSP3: | 0.46 |
| AlogP: | -0.96 | Num_rotatable_bonds: | 7 |
| MolWt: | 254.31 | Num_heavy_atoms: | 18 |
| TPSA: | 83.37 | NumAromaticRings: | 1 |
