CHEBI:77044 - (R)-bromisoval

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name (R)-bromisoval
ChEBI ID CHEBI:77044
ChEBI ASCII Name (R)-bromisoval
Definition A 2-bromo-N-carbamoyl-3-methylbutanamide that has R configuration.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C6H11BrN2O2
Net Charge 0
Average Mass 223.06800
Monoisotopic Mass 222.00039
InChI InChI=1S/C6H11BrN2O2/c1-3(2)4(7)5(10)9-6(8)11/h3-4H,1-2H3,(H3,8,9,10,11)/t4-/m1/s1
InChIKey CMCCHHWTTBEZNM-SCSAIBSYSA-N
SMILES CC(C)[C@@H](Br)C(=O)NC(N)=O
ChEBI Ontology
Outgoing (R)-bromisoval (CHEBI:77044) is a 2-bromo-N-carbamoyl-3-methylbutanamide (CHEBI:77043)
(R)-bromisoval (CHEBI:77044) is enantiomer of (S)-bromisoval (CHEBI:77045)
Incoming bromisoval (CHEBI:31304) has part (R)-bromisoval (CHEBI:77044)
(S)-bromisoval (CHEBI:77045) is enantiomer of (R)-bromisoval (CHEBI:77044)
IUPAC Name
(2R)-2-bromo-N-carbamoyl-3-methylbutanamide
Synonyms Sources
(+)-bromisoval ChEBI
(R)-(+)-bromisoval ChEBI
(R)-2-bromoisovalerylurea ChemIDplus
[(R)-α-bromo-isovaleryl]urea ChEBI
Registry Numbers Types Sources
1724350 Reaxys Registry Number Reaxys
27109-49-5 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
8422741 PubMed citation Europe PMC
Last Modified
21 January 2014