Aglycone
AD20025
Formula: C36H34O14NCl
Smiles:
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)CC(O)(C(=O)CO)CC3OC1CC(NC(=O)OCc2cc(Cl)ccc2O)C(O)C(C)O1| HBA: | 15 | RingCount: | 6 |
| HBD: | 7 | FractionCSP3: | 0.37 |
| AlogP: | 2.33 | Num_rotatable_bonds: | 8 |
| MolWt: | 728.1 | Num_heavy_atoms: | 51 |
| TPSA: | 238.61 | NumAromaticRings: | 3 |