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Ontologies
CHEBI
Chemical Entities of Biological Interest Ontology
(CHEBI)
OBO
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Last submission date May 11, 2023
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ID
http://purl.obolibrary.org/obo/CHEBI_87264
http://purl.obolibrary.org/obo/CHEBI_87264
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_87264
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Preferred name
O-fumarylcarnitine
Synonyms
3-{[(2E)-3-carboxyprop-2-enoyl]oxy}-4-(trimethylazaniumyl)butanoate
Definitions
An O-acylcarnitine in which the acyl group specified is fumaryl.
Raw data
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
obo_purl:smiles
C[N+](C)(C)CC(CC([O-])=O)OC(=O)C=C\C(O)=O
obo_purl:charge
0
obo_purl:inchikey
QMRSJQVUNCCUCI-SNAWJCMRSA-N
obo_purl:IAO_0000115
An O-acylcarnitine in which the acyl group specified is fumaryl.
skos:notation
CHEBI:87264
oboinowl_gen:hasExactSynonym
3-{[(2E)-3-carboxyprop-2-enoyl]oxy}-4-(trimethylazaniumyl)butanoate
obo_purl:mass
259.25580
obo_purl:inchi
InChI=1S/C11H17NO6/c1-12(2,3)7-8(6-10(15)16)18-11(17)5-4-9(13)14/h4-5,8H,6-7H2,1-3H3,(H-,13,14,15,16)/b5-4+
obo_purl:has_functional_parent
http://purl.obolibrary.org/obo/CHEBI_18012
obo_purl:formula
C11H17NO6
oboinowl_gen:hasOBONamespace
chebi_ontology
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:id
CHEBI:87264
rdfs:label
O-fumarylcarnitine
obo_purl:monoisotopicmass
259.10559
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_17387
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