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Concept information

Preferred term

بتیدین کینون  

Type

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

charge

  • 0

formula

  • C18H14N2O8

has_functional_parent

inchi

  • InChI=1S/C18H14N2O8/c21-14-6-9-5-13(18(27)28)20(12(9)7-15(14)22)2-1-8-3-10(16(23)24)19-11(4-8)17(25)26/h1-3,6-7,11,13H,4-5H2,(H,23,24)(H,25,26)(H,27,28)/t11-,13-/m0/s1

inchikey

  • WAVPHGICHZOYMQ-AAEUAGOBSA-N

mass

  • 386.313

monoisotopicmass

  • 386.07502

smiles

  • C(=CC=1C[C@H](N=C(C1)C(=O)O)C(=O)O)N2C3=CC(C(C=C3C[C@H]2C(O)=O)=O)=O

subset

  • 3_STAR

synonym EXACT

  • (2S)-4-{2-[(2S)-2-carboxy-5,6-dioxo-2,3,5,6-tetrahydro-1H-indol-1-yl]ethenyl}-2,3-dihydropyridine-2,6-dicarboxylic acid

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:133394

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