Glycoside
GD033473
Name:
NoneFormula:
C26H30O9N2Smiles:
C=C[C@@H]1[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)OC=C2C(=O)N3CCc4c([nH]c5cc(O)ccc45)[C@H]3C[C@H]21Aglycone:
C=CC1C(O)OC=C2C(=O)N3CCc4c([nH]c5cc(O)ccc45)C3CC21Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 6 |
| HBD: | 6 | FractionCSP3: | 0.5 |
| AlogP: | 0.18 | Num_rotatable_bonds: | 4 |
| MolWt: | 514.53 | Num_heavy_atoms: | 37 |
| TPSA: | 164.94 | NumAromaticRings: | 2 |
Unique Aglycone
AD19888
Formula: C20H20O4N2
Smiles:
C=CC1C(O)OC=C2C(=O)N3CCc4c([nH]c5cc(O)ccc45)C3CC21| HBA: | 6 | RingCount: | 5 |
| HBD: | 3 | FractionCSP3: | 0.35 |
| AlogP: | 2.35 | Num_rotatable_bonds: | 1 |
| MolWt: | 352.39 | Num_heavy_atoms: | 26 |
| TPSA: | 85.79 | NumAromaticRings: | 2 |
