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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_73028
http://purl.obolibrary.org/obo/CHEBI_73028
https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_73028
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Preferred name
O-malonylcarnitine
Synonyms
malonylcarnitine
3-[(carboxyacetyl)oxy]-4-(trimethylammonio)butanoate
3-[(carboxyacetyl)oxy]-4-(trimethylazaniumyl)butanoate
Definitions
An O-acylcarnitine having malonyl as the acyl substituent.
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)CC(O)=O
obo_purl:charge
0
obo_purl:inchikey
ZGNBLKBZJBJFDG-UHFFFAOYSA-N
obo_purl:RO_0000087
http://purl.obolibrary.org/obo/CHEBI_25212
oboinowl_gen:hasDbXref
PMID:23315938
obo_purl:IAO_0000115
An O-acylcarnitine having malonyl as the acyl substituent.
skos:notation
CHEBI:73028
oboinowl_gen:hasExactSynonym
3-[(carboxyacetyl)oxy]-4-(trimethylazaniumyl)butanoate
obo_purl:mass
247.24510
obo_purl:inchi
InChI=1S/C10H17NO6/c1-11(2,3)6-7(4-8(12)13)17-10(16)5-9(14)15/h7H,4-6H2,1-3H3,(H-,12,13,14,15)
obo_purl:has_functional_parent
http://purl.obolibrary.org/obo/CHEBI_30794
obo_purl:formula
C10H17NO6
oboinowl_gen:hasOBONamespace
chebi_ontology
rdf:type
http://www.w3.org/2002/07/owl#Class
oboinowl_gen:hasRelatedSynonym
malonylcarnitine
3-[(carboxyacetyl)oxy]-4-(trimethylammonio)butanoate
oboinowl_gen:id
CHEBI:73028
rdfs:label
O-malonylcarnitine
obo_purl:monoisotopicmass
247.10559
rdfs:subClassOf
http://purl.obolibrary.org/obo/CHEBI_17387
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