Glycoside
GD101246
Name:
NoneFormula:
C23H28O8N2Smiles:
O=C(c1cccc(Nc2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)cc2)c1)N1CCOCC1Aglycone:
O=C(c1cccc(Nc2ccc(O)cc2)c1)N1CCOCC1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.43 |
| AlogP: | 0.08 | Num_rotatable_bonds: | 6 |
| MolWt: | 460.48 | Num_heavy_atoms: | 33 |
| TPSA: | 140.95 | NumAromaticRings: | 2 |
Unique Aglycone
AD42820
Formula: C17H18O3N2
Smiles:
O=C(c1cccc(Nc2ccc(O)cc2)c1)N1CCOCC1| HBA: | 5 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.24 |
| AlogP: | 2.61 | Num_rotatable_bonds: | 3 |
| MolWt: | 298.34 | Num_heavy_atoms: | 22 |
| TPSA: | 61.8 | NumAromaticRings: | 2 |
