Glycoside
GD081360
Name:
NoneFormula:
C20H28O8N2Smiles:
O=C(C(=O)N1CCC[C@@]2(C[C@H](OCc3ccccn3)CO2)C1)[C@H](O)[C@H](O)[C@H](O)COAglycone:
c1ccc(COC2COC3(CCCNC3)C2)nc1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
| HBA: | 10 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.65 |
| AlogP: | -1.61 | Num_rotatable_bonds: | 8 |
| MolWt: | 424.45 | Num_heavy_atoms: | 30 |
| TPSA: | 149.65 | NumAromaticRings: | 1 |
Unique Aglycone
AD36655
Formula: C14H20O2N2
Smiles:
c1ccc(COC2COC3(CCCNC3)C2)nc1| HBA: | 4 | RingCount: | 3 |
| HBD: | 1 | FractionCSP3: | 0.64 |
| AlogP: | 1.51 | Num_rotatable_bonds: | 3 |
| MolWt: | 248.33 | Num_heavy_atoms: | 18 |
| TPSA: | 43.38 | NumAromaticRings: | 1 |
