CHEBI | Classes | NFDI4Biodiversity BiodivPortal

ID	http://purl.obolibrary.org/obo/CHEBI_73025 http://purl.obolibrary.org/obo/CHEBI_73025 https://biodivportal.gfbio.org/ontologies/CHEBI/CHEBI_73025 Loading
Preferred name	O-isovalerylcarnitine
Synonyms	3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)butanoate 3-methylbutyrylcarnitine
Definitions	A C5-acylcarnitine having isovaleryl as the acyl substituent.

oboinowl_gen:inSubset	http://purl.obolibrary.org/obo/chebi#3_STAR
obo_purl:smiles	CC(C)CC(=O)OC(CC([O-])=O)C[N+](C)(C)C
obo_purl:charge	0
obo_purl:inchikey	IGQBPDJNUXPEMT-UHFFFAOYSA-N
obo_purl:RO_0000087	http://purl.obolibrary.org/obo/CHEBI_77746
oboinowl_gen:hasDbXref	PMID:16602101 HMDB:HMDB0000688 PMID:23315938 Reaxys:5814736
obo_purl:IAO_0000115	A C5-acylcarnitine having isovaleryl as the acyl substituent.
skos:notation	CHEBI:73025
oboinowl_gen:hasExactSynonym	3-[(3-methylbutanoyl)oxy]-4-(trimethylammonio)butanoate
obo_purl:mass	245.31530
obo_purl:inchi	InChI=1S/C12H23NO4/c1-9(2)6-12(16)17-10(7-11(14)15)8-13(3,4)5/h9-10H,6-8H2,1-5H3
obo_purl:has_functional_parent	http://purl.obolibrary.org/obo/CHEBI_28484
obo_purl:formula	C12H23NO4
oboinowl_gen:hasOBONamespace	chebi_ontology
rdf:type	http://www.w3.org/2002/07/owl#Class
oboinowl_gen:hasRelatedSynonym	3-methylbutyrylcarnitine
oboinowl_gen:id	CHEBI:73025
rdfs:label	O-isovalerylcarnitine
obo_purl:monoisotopicmass	245.16271
rdfs:subClassOf	http://purl.obolibrary.org/obo/CHEBI_86492

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