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Concept information

Preferred term

2-oxohept-4-ene-1,7-dioate  

Type

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

charge

  • -2

formula

  • C7H6O5

inchi

  • InChI=1S/C7H8O5/c8-5(7(11)12)3-1-2-4-6(9)10/h1-2H,3-4H2,(H,9,10)(H,11,12)/p-2/b2-1+

inchikey

  • ICGKEQXHPZUYSF-OWOJBTEDSA-L

is_conjugate_base_of

mass

  • 170.12060

monoisotopicmass

  • 170.02262

smiles

  • [O-]C(=O)C/C=C/CC(=O)C([O-])=O

subset

  • 3_STAR

synonym EXACT

  • (3E)-6-oxohept-3-enedioate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:78627

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