Glycoside
GD048680
Name:
NoneFormula:
C15H19O6NSmiles:
C=Cc1ccc(CNC(=O)C(=O)[C@H](O)[C@H](O)[C@H](O)CO)cc1Aglycone:
C=Cc1ccc(CN)cc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 7 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -1.41 | Num_rotatable_bonds: | 8 |
| MolWt: | 309.32 | Num_heavy_atoms: | 22 |
| TPSA: | 127.09 | NumAromaticRings: | 1 |
Unique Aglycone
AD25941
Formula: C9H11N
Smiles:
C=Cc1ccc(CN)cc1| HBA: | 1 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.11 |
| AlogP: | 1.79 | Num_rotatable_bonds: | 2 |
| MolWt: | 133.19 | Num_heavy_atoms: | 10 |
| TPSA: | 26.02 | NumAromaticRings: | 1 |
