Glycoside
GD031288
Name:
NoneFormula:
C21H23O8NSmiles:
Cc1cccc(Nc2ccccc2C(=O)O[C@@H]2O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]2O)c1CAglycone:
Cc1cccc(Nc2ccccc2C(=O)O)c1CSugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | 1.1 | Num_rotatable_bonds: | 5 |
| MolWt: | 417.41 | Num_heavy_atoms: | 30 |
| TPSA: | 145.55 | NumAromaticRings: | 2 |
Unique Aglycone
AD20172
Formula: C15H15O2N
Smiles:
Cc1cccc(Nc2ccccc2C(=O)O)c1C| HBA: | 3 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.13 |
| AlogP: | 3.75 | Num_rotatable_bonds: | 3 |
| MolWt: | 241.29 | Num_heavy_atoms: | 18 |
| TPSA: | 49.33 | NumAromaticRings: | 2 |
