Glycoside
GD019984
Name:
NoneFormula:
C22H21O6N2ClSmiles:
OC[C@@H]1O[C@H](c2ccc(Cl)c(Cc3ccc(-c4ccoc4)nn3)c2)[C@H](O)[C@H](O)[C@H]1OAglycone:
Clc1ccccc1Cc1ccc(-c2ccoc2)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.33 |
| AlogP: | 1.5 | Num_rotatable_bonds: | 5 |
| MolWt: | 432.86 | Num_heavy_atoms: | 30 |
| TPSA: | 129.07 | NumAromaticRings: | 3 |
Unique Aglycone
AD13870
Formula: C16H11ON2Cl
Smiles:
Clc1ccccc1Cc1ccc(-c2ccoc2)nn1| HBA: | 3 | RingCount: | 3 |
| HBD: | 0 | FractionCSP3: | 0.07 |
| AlogP: | 3.98 | Num_rotatable_bonds: | 3 |
| MolWt: | 270.72 | Num_heavy_atoms: | 19 |
| TPSA: | 38.92 | NumAromaticRings: | 3 |
