BPV

Bromopyruvate

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is present as a standalone ligand in 2 entries

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Chemical Component Summary
Name	Bromopyruvate
Synonyms	Bromopyruvic acid; 3-bromo-2-oxopropanoic acid
Identifiers	3-bromo-2-oxo-propanoic acid
Formula	C₃ H₃ Br O₃
Molecular Weight	166.958
Type	NON-POLYMER
Isomeric SMILES	C(C(=O)C(=O)O)Br
InChI	InChI=1S/C3H3BrO3/c4-1-2(5)3(6)7/h1H2,(H,6,7)
InChIKey	PRRZDZJYSJLDBS-UHFFFAOYSA-N

Chemical Details
Formal Charge	0
Atom Count	10
Chiral Atom Count	0
Bond Count	9
Aromatic Bond Count	0

Drug Info: DrugBank

DrugBank ID	DB17135
Name	Bromopyruvate
Groups	investigational
Synonyms	3-bromopyruvate 3-bromo-2-oxopropanoic acid Bromopyruvic acid 3-bromopyruvic acid Bromopyruvate
Categories	Affinity Labels Compounds used in a research, industrial, or household setting Enzyme Inhibitors Indicators and Reagents Keto Acids Laboratory Chemicals Pyruvate Dehydrogenase Complex, antagonists & inhibitors
CAS number	1113-59-3

Related Resource References

Resource Name	Reference
PubChem	70684
ChEMBL	CHEMBL177837
ChEBI	CHEBI:131461, CHEBI:95046

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.