Glycoside
GD103629
Name:
3-ethyl-5-[(3-methoxy-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-oneFormula:
C19H23O8NS2Smiles:
CCN1C(=O)/C(=C/c2ccc(O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)c(OC)c2)SC1=SAglycone:
CCN1C(=O)C(=Cc2ccc(O)c(OC)c2)SC1=SSugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 9 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.47 |
| AlogP: | 0.09 | Num_rotatable_bonds: | 6 |
| MolWt: | 457.53 | Num_heavy_atoms: | 30 |
| TPSA: | 128.92 | NumAromaticRings: | 1 |
Unique Aglycone
AD43838
Formula: C13H13O3NS2
Smiles:
CCN1C(=O)C(=Cc2ccc(O)c(OC)c2)SC1=S| HBA: | 4 | RingCount: | 2 |
| HBD: | 1 | FractionCSP3: | 0.23 |
| AlogP: | 2.62 | Num_rotatable_bonds: | 3 |
| MolWt: | 295.38 | Num_heavy_atoms: | 19 |
| TPSA: | 49.77 | NumAromaticRings: | 1 |
