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CXSMILES (P10718)

From Wikidata
line notation based on the SMILES but extended to allow describing compound classes
  • ChemAxon extended SMILES
Language Label Description Also known as
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CXSMILES
    English
    CXSMILES
    line notation based on the SMILES but extended to allow describing compound classes
    • ChemAxon extended SMILES

    Data type

    String

    Statements

    [H][C@@](COC([*])=O)(COP(O)(=O)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](OP(O)(O)=O)[C@H]1O)OC([*])=O |$;;;;;_R1;;;;;;;;;;;;;;;;;;;;;;;;;_R2$|
    0 references
    [*]C(CC(C)C)C[*] |Sg:n:1,2,3,4,5,6::ht|
    0 references
    Cl*.c1ccccc1-c1ccccc1 |m:1:3.4.5.6.7.8.9|
    0 references
    https://www.simolecule.com/cdkdepict/depict/bow/svg?smi=$1&zoom=2.0&annotate=cip
    0 references

    Constraints