Glycoside
GD011127
Name:
NoneFormula:
C24H28O9NClSmiles:
O=[N+]([O-])OCCCCOc1ccc(Cc2cc([C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)ccc2Cl)cc1Aglycone:
O=[N+]([O-])OCCCCOc1ccc(Cc2ccccc2Cl)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.48 |
| AlogP: | 1.81 | Num_rotatable_bonds: | 11 |
| MolWt: | 497.93 | Num_heavy_atoms: | 34 |
| TPSA: | 151.75 | NumAromaticRings: | 2 |
Unique Aglycone
AD08528
Formula: C18H18O4NCl
Smiles:
O=[N+]([O-])OCCCCOc1ccc(Cc2ccccc2Cl)cc1| HBA: | 5 | RingCount: | 2 |
| HBD: | 0 | FractionCSP3: | 0.29 |
| AlogP: | 4.3 | Num_rotatable_bonds: | 9 |
| MolWt: | 335.79 | Num_heavy_atoms: | 23 |
| TPSA: | 61.6 | NumAromaticRings: | 2 |
