Current SMILES String

C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](O[C@@H]([C@H]2OC(=O)/C=C/C3=CC(=C(C=C3)O)O)CO)OCCC4=CC(=C(C=C4)O)O)O)O)O)O

Solvent: methanol

Chemical Shift Scatterplot

SMILES Image

The rendered SMILES image for the query string.

Query Model

Enter a SMILES String to see Predictions

Model Predictions and Ground Truth

The model predictions from the SMILES Query

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