Glycoside
GD089257
Name:
NoneFormula:
C19H23O9N3Smiles:
COc1cc(C(=O)Nc2ccn([C@@H]3O[C@H](CO)[C@@H](O)[C@@H]3O)c(=O)n2)cc(OC)c1OCAglycone:
COc1cc(C(=O)Nc2cc[nH]c(=O)n2)cc(OC)c1OCSugarmoiety:
OCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.42 |
| AlogP: | -0.87 | Num_rotatable_bonds: | 7 |
| MolWt: | 437.41 | Num_heavy_atoms: | 31 |
| TPSA: | 161.6 | NumAromaticRings: | 2 |
Unique Aglycone
AD38928
Formula: C14H15O5N3
Smiles:
COc1cc(C(=O)Nc2cc[nH]c(=O)n2)cc(OC)c1OC| HBA: | 8 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.21 |
| AlogP: | 1.05 | Num_rotatable_bonds: | 5 |
| MolWt: | 305.29 | Num_heavy_atoms: | 22 |
| TPSA: | 102.54 | NumAromaticRings: | 2 |
