CHEBI:17131 - (3,5-diiodo-4-hydroxyphenyl)pyruvic acid

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (3,5-diiodo-4-hydroxyphenyl)pyruvic acid
ChEBI ID CHEBI:17131
Definition A derivative of pyruvic acid carrying a 3,5-diiodo-4-hydroxyphenyl group at the 3-position.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:11723, CHEBI:11709, CHEBI:1404, CHEBI:19908
Supplier Information
Download Molfile XML SDF
Formula C9H6I2O4
Net Charge 0
Average Mass 431.95048
Monoisotopic Mass 431.83555
InChI InChI=1S/C9H6I2O4/c10-5-1-4(2-6(11)8(5)13)3-7(12)9(14)15/h1-2,13H,3H2,(H,14,15)
InChIKey TZPLBTUUWSVGCY-UHFFFAOYSA-N
SMILES OC(=O)C(=O)Cc1cc(I)c(O)c(I)c1
ChEBI Ontology
Outgoing (3,5-diiodo-4-hydroxyphenyl)pyruvic acid (CHEBI:17131) has functional parent pyruvic acid (CHEBI:32816)
(3,5-diiodo-4-hydroxyphenyl)pyruvic acid (CHEBI:17131) is a organoiodine compound (CHEBI:37142)
(3,5-diiodo-4-hydroxyphenyl)pyruvic acid (CHEBI:17131) is conjugate acid of (3,5-diiodo-4-oxidophenyl)pyruvate(2−) (CHEBI:58023)
Incoming (3,5-diiodo-4-oxidophenyl)pyruvate(2−) (CHEBI:58023) is conjugate base of (3,5-diiodo-4-hydroxyphenyl)pyruvic acid (CHEBI:17131)
IUPAC Name
3-(4-hydroxy-3,5-diiodophenyl)-2-oxopropanoic acid
Synonyms Sources
3,5-Diiodo-4-hydroxyphenylpyruvate KEGG COMPOUND
3-(3,5-Diiodo-4-hydroxyphenyl)pyruvate KEGG COMPOUND
beta-(3,5-diiodo-4-hydroxyphenyl)pyruvate ChEBI
Manual Xref Database
C01244 KEGG COMPOUND
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Last Modified
12 November 2010