Tag category Chem_comp_SMILES
Key tags (columns):
Tags in table Chem_comp_SMILES:
| Tag | Description | data type | Mandatory |
|---|---|---|---|
| Comp_ID | Pointer to '_Chem_comp.ID' | code | yes |
| Entry_ID | Pointer to '_Entry.ID' | code | yes |
| Sf_ID | Pointer to '_Chem_comp.Sf_ID' | int | yes |
| String | SMILES string for the chemical component. | text | yes |
| Type | The type of SMILES string provided is defined by this tag value. | line | yes |