Glycoside
GD065735
Name:
NoneFormula:
C16H22O7N2Smiles:
O=C(Nc1ccc(OCC2CCC2)nc1)C(=O)[C@H](O)[C@@H](O)[C@H](O)COAglycone:
Nc1ccc(OCC2CCC2)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.16 | Num_rotatable_bonds: | 9 |
| MolWt: | 354.36 | Num_heavy_atoms: | 25 |
| TPSA: | 149.21 | NumAromaticRings: | 1 |
Unique Aglycone
AD29823
Formula: C10H14ON2
Smiles:
Nc1ccc(OCC2CCC2)nc1| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.5 |
| AlogP: | 1.84 | Num_rotatable_bonds: | 3 |
| MolWt: | 178.23 | Num_heavy_atoms: | 13 |
| TPSA: | 48.14 | NumAromaticRings: | 1 |
