Glycoside
GD100279
Name:
NoneFormula:
C24H32O7N2Smiles:
OC[C@H]1O[C@@H](Oc2ccc(Nc3ccc(CCN4CCOCC4)cc3)cc2)[C@H](O)[C@@H](O)[C@H]1OAglycone:
Oc1ccc(Nc2ccc(CCN3CCOCC3)cc2)cc1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.5 |
| AlogP: | 0.48 | Num_rotatable_bonds: | 8 |
| MolWt: | 460.53 | Num_heavy_atoms: | 33 |
| TPSA: | 123.88 | NumAromaticRings: | 2 |
Unique Aglycone
AD42375
Formula: C18H22O2N2
Smiles:
Oc1ccc(Nc2ccc(CCN3CCOCC3)cc2)cc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 3.01 | Num_rotatable_bonds: | 5 |
| MolWt: | 298.39 | Num_heavy_atoms: | 22 |
| TPSA: | 44.73 | NumAromaticRings: | 2 |