Glycoside
GD081968
Name:
NoneFormula:
C19H22O6N4Smiles:
Cn1cc(-n2cc(C(=O)N[C@H]3[C@H](O)O[C@H](CO)[C@@H](O)[C@@H]3O)c3ccccc32)cn1Aglycone:
Cn1cc(-n2cc(C(N)=O)c3ccccc32)cn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.37 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 4 |
| MolWt: | 402.41 | Num_heavy_atoms: | 29 |
| TPSA: | 142.0 | NumAromaticRings: | 3 |
Unique Aglycone
AD36810
Formula: C13H12ON4
Smiles:
Cn1cc(-n2cc(C(N)=O)c3ccccc32)cn1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.08 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 2 |
| MolWt: | 240.27 | Num_heavy_atoms: | 18 |
| TPSA: | 65.84 | NumAromaticRings: | 3 |
