Glycoside
GD101296
Name:
NoneFormula:
C24H32O8N2Smiles:
OC[C@H]1O[C@@H](Oc2ccc(Nc3ccc(OCCN4CCOCC4)cc3)cc2)[C@H](O)[C@@H](O)[C@H]1OAglycone:
Oc1ccc(Nc2ccc(OCCN3CCOCC3)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.32 | Num_rotatable_bonds: | 9 |
| MolWt: | 476.53 | Num_heavy_atoms: | 34 |
| TPSA: | 133.11 | NumAromaticRings: | 2 |
Unique Aglycone
AD42858
Formula: C18H22O3N2
Smiles:
Oc1ccc(Nc2ccc(OCCN3CCOCC3)cc2)cc1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 2.85 | Num_rotatable_bonds: | 6 |
| MolWt: | 314.38 | Num_heavy_atoms: | 23 |
| TPSA: | 53.96 | NumAromaticRings: | 2 |