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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_71179
http://purl.obolibrary.org/obo/CHEBI_71179
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_71179
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Preferred name
O-tiglylcarnitine
Synonyms
3-{[(2E)-2-methylbut-2-enoyl]oxy}-4-(trimethylazaniumyl)butanoate
tiglylcarnitine
3-{[(2E)-2-methylbut-2-enoyl]oxy}-4-(trimethylammonio)butanoate
Definitions
An O-acylcarnitine compound having trans-2-methyl-2-butenoyl (tiglyl) as the acyl substituent.
Raw data
rdf:type
http://www.w3.org/2002/07/owl#Class
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rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_17387
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rdfs:label
O-tiglylcarnitine
obo_purl:charge
0
obo_purl:formula
C12H21NO4
obo_purl:inchi
InChI=1S/C12H21NO4/c1-6-9(2)12(16)17-10(7-11(14)15)8-13(3,4)5/h6,10H,7-8H2,1-5H3/b9-6+
obo_purl:inchikey
WURBQCVBQNMUQT-RMKNXTFCSA-N
obo_purl:mass
243.29940
obo_purl:monoisotopicmass
243.14706
obo_purl:smiles
C\C=C(/C)C(=O)OC(CC([O-])=O)C[N+](C)(C)C
obo_purl:IAO_0000115
An O-acylcarnitine compound having trans-2-methyl-2-butenoyl (tiglyl) as the acyl substituent.
oboinowl_gen:hasExactSynonym
3-{[(2E)-2-methylbut-2-enoyl]oxy}-4-(trimethylazaniumyl)butanoate
oboinowl_gen:hasRelatedSynonym
tiglylcarnitine
3-{[(2E)-2-methylbut-2-enoyl]oxy}-4-(trimethylammonio)butanoate
oboinowl_gen:hasDbXref
PMID:22770225
PMID:23315938
CAS:64191-86-2
HMDB:HMDB0002366
PMID:14518824
oboinowl_gen:hasOBONamespace
chebi_ontology
oboinowl_gen:id
CHEBI:71179
skos:notation
CHEBI:71179
oboinowl_gen:inSubset
http://purl.obolibrary.org/obo/chebi#3_STAR
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obo_purl:RO_0000087
http://purl.obolibrary.org/obo/CHEBI_77746
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obo_purl:has_functional_parent
http://purl.obolibrary.org/obo/CHEBI_9592
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obo_purl:is_tautomer_of
http://purl.obolibrary.org/obo/CHEBI_71180
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