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Caffeine Citrate

Caffeine Citrate

API0231765

Caffeine Citrate

Caffeine is a central nervous system stimulant.

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API Description
API Details
Document
Related Patent Status
  • CAS No.

    69-22-7

  • Synonyms

    Caffeine citrate; 69-22-7; Caffeine, Citrated

  • CHEMBL ID

    CHEMBL1200569

  • Indications

  • Molecule Type

    Small molecule

  • Compound CID

    6241

  • Molecular Weight (g/mol)

    386.31

  • Molecular Formula

    C14H18N4O9

  • InChI

    InChI=1S/C8H10N4O2.C6H8O7/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;7-3(8)1-6(13,5(11)12)2-4(9)10/h4H,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

  • InChIKey

    RCQXSQPPHJPGOF-UHFFFAOYSA-N

  • SMILES

    CN1C=NC2=C1C(=O)N(C(=O)N2C)C.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

  • IUPAC Name

    2-hydroxypropane-1,2,3-tricarboxylic acid;1,3,7-trimethylpurine-2,6-dione

  • Exact Mass (Da)

    386.10737816

  • Monoisotopic Mass (Da)

    386.10737816

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