Glycoside
GD025089
Name:
NoneFormula:
C22H27O6NSmiles:
CNC(=O)c1cccc(-c2ccc(C[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(C)c2)c1Aglycone:
CNC(=O)c1cccc(-c2ccc(C)c(C)c2)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 7 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.41 |
| AlogP: | 0.41 | Num_rotatable_bonds: | 5 |
| MolWt: | 401.46 | Num_heavy_atoms: | 29 |
| TPSA: | 119.25 | NumAromaticRings: | 2 |
Unique Aglycone
AD16677
Formula: C16H17ON
Smiles:
CNC(=O)c1cccc(-c2ccc(C)c(C)c2)c1| HBA: | 2 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.19 |
| AlogP: | 3.33 | Num_rotatable_bonds: | 2 |
| MolWt: | 239.32 | Num_heavy_atoms: | 18 |
| TPSA: | 29.1 | NumAromaticRings: | 2 |
