Glycoside
GD056602
Name:
NoneFormula:
C15H22O6N2Smiles:
CN(C)C(=O)c1cccc(N[C@H]2[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)c1Aglycone:
CN(C)C(=O)c1cccc(N)c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | -1.4 | Num_rotatable_bonds: | 4 |
| MolWt: | 326.35 | Num_heavy_atoms: | 23 |
| TPSA: | 122.49 | NumAromaticRings: | 1 |
Unique Aglycone
AD28444
Formula: C9H12ON2
Smiles:
CN(C)C(=O)c1cccc(N)c1| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.22 |
| AlogP: | 0.97 | Num_rotatable_bonds: | 1 |
| MolWt: | 164.21 | Num_heavy_atoms: | 12 |
| TPSA: | 46.33 | NumAromaticRings: | 1 |
