EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:133621 - valanimycin

ChEBI IDCHEBI:133621
ChEBI Namevalanimycin
Stars
DefinitionAn azoxy compound that is acrylic acid in which the olefinic hydrogen at position 2 has been replaced by an isobutyl-ONN-azoxy group.
Last Modified20 February 2017
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC7H12N2O3
Net Charge0
Average Mass172.184
Monoisotopic Mass172.08479
SMILESC=C(/N=[N+](\[O-])CC(C)C)C(=O)O
InChIInChI=1S/C7H12N2O3/c1-5(2)4-9(12)8-6(3)7(10)11/h5H,3-4H2,1-2H3,(H,10,11)/b9-8-
InChIKeyDTXMRELKPKEPSO-HJWRWDBZSA-N
Species of MetaboliteComponentSourceComments
Streptomyces viridifaciens (ncbitaxon:48665) - PubMed (18451033) Strain: MG456-hF10
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
antimicrobial agent  A substance that kills or slows the growth of microorganisms, including bacteria, viruses, fungi and protozoans.
bacterial metabolite  Any prokaryotic metabolite produced during a metabolic reaction in bacteria.
ChEBI Ontology
Outgoing Relation(s)
valanimycin (CHEBI:133621) has functional parent acrylic acid (CHEBI:18308)
valanimycin (CHEBI:133621) has role antimicrobial agent (CHEBI:33281)
valanimycin (CHEBI:133621) has role bacterial metabolite (CHEBI:76969)
valanimycin (CHEBI:133621) is a azoxy compound (CHEBI:37390)
valanimycin (CHEBI:133621) is a α,β-unsaturated monocarboxylic acid (CHEBI:79020)
IUPAC Name 
2-[(2-methylpropyl)-ONN-azoxy]prop-2-enoic acid
Synonyms  Source
2-(Isobutyl-(ONN)azoxy)acrylic acidChemIDplus
2-[(2-methylpropyl)-ONN-azoxy]acrylic acidChEBI
Manual XrefsDatabases
C00017752KNApSAcK
Registry NumbersSources
Reaxys:21142834Reaxys
CAS:101961-60-8ChemIDplus
Citations