CHEBI:72708 - cis-dihomoaconitic acid

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ChEBI Name cis-dihomoaconitic acid ChEBI ID CHEBI:72708 ChEBI ASCII Name cis-dihomoaconitic acid Definition A tricarboxylic acid that consists of pent-1-ene having three carboxy groups located at positions 1, 2 and 5 (the Z-geoisomer). Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat Supplier Information ZINC000059206906 Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C8H10O6 Net Charge 0 Average Mass 202.16140 Monoisotopic Mass 202.04774 InChI InChI=1S/C8H10O6/c9-6(10)3-1-2-5(8(13)14)4-7(11)12/h4H,1-3H2,(H,9,10)(H,11,12)(H,13,14)/b5-4- InChIKey WXZASCSXAMHFCX-PLNGDYQASA-N SMILES OC(=O)CCC\C(=C\C(O)=O)C(O)=O Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing cis-dihomoaconitic acid (CHEBI:72708) is a tricarboxylic acid (CHEBI:27093) cis-dihomoaconitic acid (CHEBI:72708) is conjugate acid of cis-dihomoaconitate(3−) (CHEBI:72710) Incoming cis-dihomoaconitate(3−) (CHEBI:72710) is conjugate base of cis-dihomoaconitic acid (CHEBI:72708) IUPAC Name (1Z)-pent-1-ene-1,2,5-tricarboxylic acid Synonyms Sources (Z)-1,2,5-pent-1-enetricarboxylic acid SUBMITTER (Z)-dihomoaconitic acid ChEBI Manual Xref Database CPD-153 MetaCyc View more database links Registry Number Type Source 21144463 Reaxys Registry Number Reaxys Last Modified 08 March 2013