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CHEBI:37154 - fumarate(1−)

ChEBI IDCHEBI:37154
ChEBI Namefumarate(1−)
Stars
ASCII Namefumarate(1-)
DefinitionA hydrogen butenedioate obtained by deprotonation of one of the carboxy groups of fumaric acid.
Last Modified13 March 2018
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC4H3O4
Net Charge-1
Average Mass115.064
Monoisotopic Mass115.00368
SMILESO=C([O-])/C=C/C(=O)O
InChIInChI=1S/C4H4O4/c5-3(6)1-2-4(7)8/h1-2H,(H,5,6)(H,7,8)/p-1/b2-1+
InChIKeyVZCYOOQTPOCHFL-OWOJBTEDSA-M
Roles Classification
Biological Role:
fundamental metabolite  Any metabolite produced by all living cells.
ChEBI Ontology
Outgoing Relation(s)
fumarate(1−) (CHEBI:37154) has role fundamental metabolite (CHEBI:78675)
fumarate(1−) (CHEBI:37154) is a hydrogen butenedioate (CHEBI:37155)
fumarate(1−) (CHEBI:37154) is conjugate acid of fumarate(2−) (CHEBI:29806)
fumarate(1−) (CHEBI:37154) is conjugate base of fumaric acid (CHEBI:18012)
Incoming Relation(s)
ketotifen fumarate (CHEBI:31750) has part fumarate(1−) (CHEBI:37154)
monosodium fumarate (CHEBI:115087) has part fumarate(1−) (CHEBI:37154)
Ro 48-8071 fumarate (CHEBI:101097) has part fumarate(1−) (CHEBI:37154)
fumaric acid (CHEBI:18012) is conjugate acid of fumarate(1−) (CHEBI:37154)
fumarate(2−) (CHEBI:29806) is conjugate base of fumarate(1−) (CHEBI:37154)
IUPAC Name 
(2E)-3-carboxyprop-2-enoate
Synonyms  Source
(2E)-3-carboxyacrylateIUPAC
hydrogen fumarateChEBI
fumarate monoanionChEBI
Registry NumbersSources
Gmelin:325290Gmelin
Reaxys:1906438Reaxys