Glycoside
GD011914
Name:
NoneFormula:
C21H24O8N2Smiles:
COc1ccc(C=NNC(=O)c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)cc1Aglycone:
COc1ccc(C=NNC(=O)c2ccc(O)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 5 | FractionCSP3: | 0.33 |
| AlogP: | -0.36 | Num_rotatable_bonds: | 7 |
| MolWt: | 432.43 | Num_heavy_atoms: | 31 |
| TPSA: | 150.07 | NumAromaticRings: | 2 |
Unique Aglycone
AD09031
Formula: C15H14O3N2
Smiles:
COc1ccc(C=NNC(=O)c2ccc(O)cc2)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 2.16 | Num_rotatable_bonds: | 4 |
| MolWt: | 270.29 | Num_heavy_atoms: | 20 |
| TPSA: | 70.92 | NumAromaticRings: | 2 |
