Glycoside
GD076299
Name:
NoneFormula:
C15H18O7N2F2Smiles:
C#CCN1C[C@@]2(F)CN(C(=O)C(=O)[C@H](O)[C@@H](O)[C@@H](O)CO)C[C@@]2(F)C1=OAglycone:
C#CCN1CC2(F)CNCC2(F)C1=OSugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 9 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.67 |
| AlogP: | -3.64 | Num_rotatable_bonds: | 6 |
| MolWt: | 376.31 | Num_heavy_atoms: | 26 |
| TPSA: | 138.61 | NumAromaticRings: | 0 |
Unique Aglycone
AD35213
Formula: C9H10ON2F2
Smiles:
C#CCN1CC2(F)CNCC2(F)C1=O| HBA: | 3 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.67 |
| AlogP: | -0.52 | Num_rotatable_bonds: | 1 |
| MolWt: | 200.19 | Num_heavy_atoms: | 14 |
| TPSA: | 32.34 | NumAromaticRings: | 0 |
