Glycoside
GD059839
Name:
NoneFormula:
C18H21O6NSmiles:
Cc1ccc(CNC(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)c2ccccc12Aglycone:
Cc1ccc(CN)c2ccccc12Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.59 | Num_rotatable_bonds: | 7 |
| MolWt: | 347.37 | Num_heavy_atoms: | 25 |
| TPSA: | 127.09 | NumAromaticRings: | 2 |
Unique Aglycone
AD29574
Formula: C12H13N
Smiles:
Cc1ccc(CN)c2ccccc12| HBA: | 1 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.17 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 1 |
| MolWt: | 171.24 | Num_heavy_atoms: | 13 |
| TPSA: | 26.02 | NumAromaticRings: | 2 |
