Glycoside
GD017633
Name:
NoneFormula:
C21H23O9NSmiles:
O=C(O)CNC(=O)c1cccc(-c2ccccc2O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)c1Aglycone:
O=C(O)CNC(=O)c1cccc(-c2ccccc2O)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | -0.65 | Num_rotatable_bonds: | 7 |
| MolWt: | 433.41 | Num_heavy_atoms: | 31 |
| TPSA: | 165.78 | NumAromaticRings: | 2 |
Unique Aglycone
AD12568
Formula: C15H13O4N
Smiles:
O=C(O)CNC(=O)c1cccc(-c2ccccc2O)c1| HBA: | 5 | RingCount: | 2 |
| HBD: | 3 | FractionCSP3: | 0.07 |
| AlogP: | 1.87 | Num_rotatable_bonds: | 4 |
| MolWt: | 271.27 | Num_heavy_atoms: | 20 |
| TPSA: | 86.63 | NumAromaticRings: | 2 |
