Glycoside
GD088605
Name:
NoneFormula:
C20H25O8N3Smiles:
CCOC(=O)c1nn(-c2ccccc2C(=O)N[C@H]2[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]2O)cc1CAglycone:
CCOC(=O)c1nn(-c2ccccc2C(N)=O)cc1CSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.45 |
| AlogP: | -1.11 | Num_rotatable_bonds: | 6 |
| MolWt: | 435.43 | Num_heavy_atoms: | 31 |
| TPSA: | 163.37 | NumAromaticRings: | 2 |
Unique Aglycone
AD38773
Formula: C14H15O3N3
Smiles:
CCOC(=O)c1nn(-c2ccccc2C(N)=O)cc1C| HBA: | 6 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 1.46 | Num_rotatable_bonds: | 4 |
| MolWt: | 273.29 | Num_heavy_atoms: | 20 |
| TPSA: | 87.21 | NumAromaticRings: | 2 |
