CHEBI:15664 - (2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate

ChEBI IDCHEBI:15664
ChEBI Name(2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate
Stars
ASCII Name(2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate
DefinitionA prenol phosphate comprising (2E)-4-hydroxy-3-methylbut-2-en-1-ol having an O-diphosphate substituent.
Secondary ChEBI IDsCHEBI:632, CHEBI:10952
Last Modified22 August 2017
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC5H12O8P2
Net Charge0
Average Mass262.091
Monoisotopic Mass262.00074
SMILESC/C(=C\COP(=O)(O)OP(=O)(O)O)CO
InChIInChI=1S/C5H12O8P2/c1-5(4-6)2-3-12-15(10,11)13-14(7,8)9/h2,6H,3-4H2,1H3,(H,10,11)(H2,7,8,9)/b5-2+
InChIKeyMDSIZRKJVDMQOQ-GORDUTHDSA-N
Species of MetaboliteComponentSourceComments
Escherichia coli (ncbitaxon:562) - PubMed (21988831)
Roles Classification
Biological Roles:
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.
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.
ChEBI Ontology
Outgoing Relation(s)
(2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate (CHEBI:15664) has role Escherichia coli metabolite (CHEBI:76971)
(2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate (CHEBI:15664) has role epitope (CHEBI:53000)
(2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate (CHEBI:15664) has role phosphoantigen (CHEBI:59544)
(2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate (CHEBI:15664) is a prenol phosphate (CHEBI:26250)
(2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate (CHEBI:15664) is conjugate acid of (2E)-4-hydroxy-3-methylbut-2-enyl diphosphate(3−) (CHEBI:128753)
Incoming Relation(s)
(2E)-4-hydroxy-3-methylbut-2-enyl diphosphate(3−) (CHEBI:128753) is conjugate base of (2E)-4-hydroxy-3-methylbut-2-en-1-yl diphosphate (CHEBI:15664)
IUPAC Name 
(2E)-4-hydroxy-3-methylbut-2-en-1-yl trihydrogen diphosphate
Synonyms  Source
1-Hydroxy-2-methyl-2-butenyl 4-diphosphateKEGG COMPOUND
(E)-4-Hydroxy-3-methylbut-2-enyl diphosphateKEGG COMPOUND
(2E)-4-hydroxy-3-methylbut-2-en-1-yl pyrophosphateChEBI
(E)-4-hydroxy-3-methylbut-2-enyl pyrophosphateChEBI
(E)-4-hydroxy-3-methyl-2-buten-1-yl diphosphateChEBI
(E)-4-hydroxy-3-methyl-2-buten-1-yl pyrophosphateChEBI
Manual XrefsDatabases
C11811KEGG COMPOUND
H6PPDBeChem
C00007567KNApSAcK
Registry NumbersSources
Reaxys:9060574Reaxys
Citations