CHEBI:72711 - cis-trihomoaconitic acid

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ChEBI Name cis-trihomoaconitic acid ChEBI ID CHEBI:72711 ChEBI ASCII Name cis-trihomoaconitic acid Definition A tricarboxylic acid that consists of hex-1-ene having three carboxy groups located at positions 1, 2 and 6 (the Z-geoisomer). Stars This entity has been manually annotated by the ChEBI Team. Submitter Anne Morgat 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 C9H12O6 Net Charge 0 Average Mass 216.18800 Monoisotopic Mass 216.06339 InChI InChI=1S/C9H12O6/c10-7(11)4-2-1-3-6(9(14)15)5-8(12)13/h5H,1-4H2,(H,10,11)(H,12,13)(H,14,15)/b6-5- InChIKey NGULBISQWGMRGK-WAYWQWQTSA-N SMILES OC(=O)CCCC\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-trihomoaconitic acid (CHEBI:72711) is a tricarboxylic acid (CHEBI:27093) cis-trihomoaconitic acid (CHEBI:72711) is conjugate acid of cis-trihomoaconitate(3−) (CHEBI:72712) Incoming cis-trihomoaconitate(3−) (CHEBI:72712) is conjugate base of cis-trihomoaconitic acid (CHEBI:72711) IUPAC Name (1Z)-hex-1-ene-1,2,6-tricarboxylic acid Synonyms Sources (Z)-1,2,6-hex-1-enetricarboxylic acid SUBMITTER (Z)-trihomoaconitic acid ChEBI cis-(homo)3aconitic acid SUBMITTER Manual Xref Database CPD-319 MetaCyc View more database links Registry Number Type Source 21144464 Reaxys Registry Number Reaxys Last Modified 08 March 2013