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Concept information

Preferred term

1-(3-carboxypropyl)-3,7-dimethylxanthine  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C11H14N4O4

inchi

  • InChI=1S/C11H14N4O4/c1-13-6-12-9-8(13)10(18)15(11(19)14(9)2)5-3-4-7(16)17/h6H,3-5H2,1-2H3,(H,16,17)

inchikey

  • WKASGTGXOGALBG-UHFFFAOYSA-N

mass

  • 266.257

monoisotopicmass

  • 266.10150

smiles

  • O=C1N(CCCC(O)=O)C(=O)N(C=2N=CN(C21)C)C

subset

  • 2_STAR

synonym EXACT

  • 4-(3,7-dimethyl-2,6-dioxopurin-1-yl)butanoic acid

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:177946

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