Glycoside
GD095116
Name:
NoneFormula:
C22H30O9N2Smiles:
CC(C)(C)OC(=O)CN1C(=O)[C@@H](NC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)CO)CCc2ccccc21Aglycone:
CC(C)(C)OC(=O)CN1C(=O)C(N)CCc2ccccc21Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 11 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.55 |
| AlogP: | -1.56 | Num_rotatable_bonds: | 8 |
| MolWt: | 466.49 | Num_heavy_atoms: | 33 |
| TPSA: | 173.7 | NumAromaticRings: | 1 |
Unique Aglycone
AD40617
Formula: C16H22O3N2
Smiles:
CC(C)(C)OC(=O)CN1C(=O)C(N)CCc2ccccc21| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.63 | Num_rotatable_bonds: | 2 |
| MolWt: | 290.36 | Num_heavy_atoms: | 21 |
| TPSA: | 72.63 | NumAromaticRings: | 1 |
