<?xml version="1.0" encoding="UTF-8"?>
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<rdfs:subClassOf rdf:resource="http://purl.obolibrary.org/obo/CHEBI_24431"/>
<rdfs:label>O-malonylcarnitine</rdfs:label>
<ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
<ns0:generalized_empirical_formula>C10H17NO6</ns0:generalized_empirical_formula>
<ns0:inchi_key_string>ZGNBLKBZJBJFDG-UHFFFAOYSA-N</ns0:inchi_key_string>
<ns0:inchi_string>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)</ns0:inchi_string>
<ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">247.247</ns0:mass>
<ns0:monoisotopic_mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">247.10559</ns0:monoisotopic_mass>
<ns0:smiles_string>C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CC(=O)O</ns0:smiles_string>
<skos:notation>CHEBI:73028</skos:notation>
<obo_purl:IAO_0000115>An <em>O</em>-acylcarnitine having malonyl as the acyl substituent.</obo_purl:IAO_0000115>
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<?xml version="1.0" encoding="UTF-8"?>
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<ns0:charge rdf:datatype="http://www.w3.org/2001/XMLSchema#integer">0</ns0:charge>
<ns0:generalized_empirical_formula>C10H17NO6</ns0:generalized_empirical_formula>
<ns0:inchi_key_string>ZGNBLKBZJBJFDG-UHFFFAOYSA-N</ns0:inchi_key_string>
<ns0:inchi_string>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)</ns0:inchi_string>
<ns0:mass rdf:datatype="http://www.w3.org/2001/XMLSchema#decimal">247.247</ns0:mass>
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<ns0:smiles_string>C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CC(=O)O</ns0:smiles_string>
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