Glycoside
GD015511
Name:
EchosideFormula:
C26H23O9NSSmiles:
Cn1c(=O)sc2c(-c3ccccc3)c(O)c(O[C@@H]3O[C@H](C(=O)O)[C@H](O)[C@H](O)[C@H]3O)c(-c3ccccc3)c21Aglycone:
Cn1c(=O)sc2c(-c3ccccc3)c(O)c(O)c(-c3ccccc3)c21Sugarmoiety:
O=C(O)C1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 5 |
| HBD: | 5 | FractionCSP3: | 0.23 |
| AlogP: | 1.91 | Num_rotatable_bonds: | 5 |
| MolWt: | 525.54 | Num_heavy_atoms: | 37 |
| TPSA: | 158.68 | NumAromaticRings: | 4 |
Unique Aglycone
AD11259
Formula: C20H15O3NS
Smiles:
Cn1c(=O)sc2c(-c3ccccc3)c(O)c(O)c(-c3ccccc3)c21| HBA: | 4 | RingCount: | 4 |
| HBD: | 2 | FractionCSP3: | 0.05 |
| AlogP: | 4.35 | Num_rotatable_bonds: | 2 |
| MolWt: | 349.41 | Num_heavy_atoms: | 25 |
| TPSA: | 62.46 | NumAromaticRings: | 4 |
