CHEBI:15708 - trans-aconitate(3−)

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ChEBI Name trans-aconitate(3−) ChEBI ID CHEBI:15708 ChEBI ASCII Name trans-aconitate(3-) Definition An aconitate(3−) that is the conjugate base of trans-aconitic acid. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:27069, CHEBI:46108, CHEBI:12878, CHEBI:12869 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C6H3O6 Net Charge -3 Average Mass 171.08442 Monoisotopic Mass 170.99461 InChI InChI=1S/C6H6O6/c7-4(8)1-3(6(11)12)2-5(9)10/h1H,2H2,(H,7,8)(H,9,10)(H,11,12)/p-3/b3-1+ InChIKey GTZCVFVGUGFEME-HNQUOIGGSA-K SMILES [O-]C(=O)C\C(=C/C([O-])=O)C([O-])=O Metabolite of Species Details Saccharomyces cerevisiae (NCBI:txid4932) Source: yeast.sf.net See: PubMed Roles Classification Biological Role(s): fundamental metabolite Any metabolite produced by all living cells. View more via ChEBI Ontology ChEBI Ontology Outgoing trans-aconitate(3−) (CHEBI:15708) has role fundamental metabolite (CHEBI:78675) trans-aconitate(3−) (CHEBI:15708) is a aconitate(3−) (CHEBI:22210) trans-aconitate(3−) (CHEBI:15708) is conjugate base of trans-aconitic acid (CHEBI:32806) Incoming trans-aconitic acid (CHEBI:32806) is conjugate acid of trans-aconitate(3−) (CHEBI:15708) IUPAC Name (1E)-prop-1-ene-1,2,3-tricarboxylate Synonyms Sources ACONITATE ION PDBeChem trans-aconitate UniProt Manual Xrefs Databases C02341 KEGG COMPOUND DB04351 DrugBank TRA PDBeChem View more database links Registry Numbers Types Sources 329167 Gmelin Registry Number Gmelin 3907462 Beilstein Registry Number Beilstein Last Modified 21 January 2016