Glycoside
GD045163
Name:
NoneFormula:
C11H17O7NSmiles:
COCC#CC(=O)N[C@H]1[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]1OAglycone:
COCC#CC(N)=OSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.73 |
| AlogP: | -3.45 | Num_rotatable_bonds: | 3 |
| MolWt: | 275.26 | Num_heavy_atoms: | 19 |
| TPSA: | 128.48 | NumAromaticRings: | 0 |
Unique Aglycone
AD25217
Formula: C5H7O2N
Smiles:
COCC#CC(N)=O| HBA: | 3 | RingCount: | 0 |
| HBD: | 2 | FractionCSP3: | 0.4 |
| AlogP: | -0.88 | Num_rotatable_bonds: | 1 |
| MolWt: | 113.12 | Num_heavy_atoms: | 8 |
| TPSA: | 52.32 | NumAromaticRings: | 0 |
