Glycoside
GD015859
Name:
NoneFormula:
C28H27O8N4ClSmiles:
CN(Cc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1)c1ccc([N+](=O)[O-])c2nonc12Aglycone:
CN(Cc1ccc(Cc2ccccc2Cl)cc1)c1ccc([N+](=O)[O-])c2nonc12Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 12 | RingCount: | 5 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 2.53 | Num_rotatable_bonds: | 8 |
| MolWt: | 570.99 | Num_heavy_atoms: | 40 |
| TPSA: | 175.45 | NumAromaticRings: | 4 |
Unique Aglycone
AD11473
Formula: C22H17O3N4Cl
Smiles:
CN(Cc1ccc(Cc2ccccc2Cl)cc1)c1ccc([N+](=O)[O-])c2nonc12| HBA: | 7 | RingCount: | 4 |
| HBD: | 0 | FractionCSP3: | 0.14 |
| AlogP: | 5.01 | Num_rotatable_bonds: | 6 |
| MolWt: | 408.85 | Num_heavy_atoms: | 29 |
| TPSA: | 85.3 | NumAromaticRings: | 4 |
