CHEBI:16584 - isopentenyl diphosphate

ChEBI IDCHEBI:16584
ChEBI Nameisopentenyl diphosphate
Stars
DefinitionA prenol phosphate comprising 3-methylbut-3-en-1-ol having an O-diphosphate substituent.
Secondary ChEBI IDsCHEBI:6037, CHEBI:14473, CHEBI:24907
Last Modified21 April 2017
DownloadsMolfile
FormulaC5H12O7P2
Net Charge0
Average Mass246.092
Monoisotopic Mass246.00583
SMILESC=C(C)CCOP(=O)(O)OP(=O)(O)O
InChIInChI=1S/C5H12O7P2/c1-5(2)3-4-11-14(9,10)12-13(6,7)8/h1,3-4H2,2H3,(H,9,10)(H2,6,7,8)
InChIKeyNUHSROFQTUXZQQ-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Role:
antioxidant  A substance that opposes oxidation or inhibits reactions brought about by dioxygen or peroxides.
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
phosphoantigen  Any antigen that is a phosphorylated microbial metabolite which activates an immune response in humans.
epitope  The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
antigen  Any substance that stimulates an immune response in the body, such as through antibody production or by presentation to a T-cell receptor after binding to a major histocompability complex (MHC).
ChEBI Ontology
Outgoing Relation(s)
isopentenyl diphosphate (CHEBI:16584) has role Escherichia coli metabolite (CHEBI:76971)
isopentenyl diphosphate (CHEBI:16584) has role antigen (CHEBI:59132)
isopentenyl diphosphate (CHEBI:16584) has role antioxidant (CHEBI:22586)
isopentenyl diphosphate (CHEBI:16584) has role epitope (CHEBI:53000)
isopentenyl diphosphate (CHEBI:16584) has role mouse metabolite (CHEBI:75771)
isopentenyl diphosphate (CHEBI:16584) has role phosphoantigen (CHEBI:59544)
isopentenyl diphosphate (CHEBI:16584) is a prenol phosphate (CHEBI:26250)
isopentenyl diphosphate (CHEBI:16584) is conjugate acid of isopentenyl diphosphate(3−) (CHEBI:128769)
Incoming Relation(s)
isopentenyl diphosphate(3−) (CHEBI:128769) is conjugate base of isopentenyl diphosphate (CHEBI:16584)
IUPAC Name 
3-methylbut-3-en-1-yl trihydrogen diphosphate
Synonyms  Source
3-Methyl-3-butenyl pyrophosphateChemIDplus
3-methylbut-3-en-1-yl trihydrogen diphosphatePDBeChem
3-methylbut-3-enyl phosphono hydrogen phosphatePDBeChem
delta3-isopentenyl diphosphateChEBI
delta3-Isopentenyl diphosphateKEGG COMPOUND
delta-3-Isopentenyl pyrophosphateChemIDplus
Manual XrefsDatabases
C00000848KNApSAcK
C00129KEGG COMPOUND
C00129KEGG COMPOUND
DB04714DrugBank
IPEPDBeChem
Isopentenyl pyrophosphateWikipedia
LMPR01010008LIPID MAPS
Registry NumbersSources
Reaxys:1713792Reaxys
CAS:358-71-4KEGG COMPOUND
CAS:358-71-4ChemIDplus
Citations