Glycoside
GD032161
Name:
NoneFormula:
C19H24O7N2Smiles:
Cc1ccc(-c2cnc(CCC(=O)N[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)o2)cc1Aglycone:
Cc1ccc(-c2cnc(CCC(N)=O)o2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.47 |
| AlogP: | -0.5 | Num_rotatable_bonds: | 6 |
| MolWt: | 392.41 | Num_heavy_atoms: | 28 |
| TPSA: | 145.28 | NumAromaticRings: | 2 |
Unique Aglycone
AD20649
Formula: C13H14O2N2
Smiles:
Cc1ccc(-c2cnc(CCC(N)=O)o2)cc1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.23 |
| AlogP: | 2.07 | Num_rotatable_bonds: | 4 |
| MolWt: | 230.27 | Num_heavy_atoms: | 17 |
| TPSA: | 69.12 | NumAromaticRings: | 2 |
