Glycoside
GD101767
Name:
NoneFormula:
C24H27O8N2ClSmiles:
O=C(c1cc(Nc2ccc(O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O)cc2)ccc1Cl)N1CCOCC1Aglycone:
O=C(c1cc(Nc2ccc(O)cc2)ccc1Cl)N1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.73 | Num_rotatable_bonds: | 6 |
| MolWt: | 494.93 | Num_heavy_atoms: | 34 |
| TPSA: | 140.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD43095
Formula: C18H17O3N2Cl
Smiles:
O=C(c1cc(Nc2ccc(O)cc2)ccc1Cl)N1CCOCC1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 3.26 | Num_rotatable_bonds: | 3 |
| MolWt: | 332.79 | Num_heavy_atoms: | 23 |
| TPSA: | 61.8 | NumAromaticRings: | 2 |
