Glycoside
GD020358
Name:
NoneFormula:
C23H21O6N3Cl2Smiles:
O=C(NCc1cc(Cl)cc(Cl)c1)c1ccc2[nH]c([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)nc2c1Aglycone:
O=C(NCc1cc(Cl)cc(Cl)c1)c1ccc2[nH]cnc2c1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 6 | FractionCSP3: | 0.33 |
| AlogP: | 1.31 | Num_rotatable_bonds: | 5 |
| MolWt: | 482.32 | Num_heavy_atoms: | 32 |
| TPSA: | 147.93 | NumAromaticRings: | 3 |
Unique Aglycone
AD14068
Formula: C17H11ON3Cl2
Smiles:
O=C(NCc1cc(Cl)cc(Cl)c1)c1ccc2[nH]cnc2c1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.07 |
| AlogP: | 3.8 | Num_rotatable_bonds: | 3 |
| MolWt: | 320.18 | Num_heavy_atoms: | 21 |
| TPSA: | 57.78 | NumAromaticRings: | 3 |
