CHEBI:196298 - Octadecyl isobutyrate

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Octadecyl isobutyrate
ChEBI ID CHEBI:196298
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H44O2
Net Charge 0
Average Mass 340.592
Monoisotopic Mass 340.33413
InChI InChI=1S/C22H44O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-24-22(23)21(2)3/h21H,4-20H2,1-3H3
InChIKey BFOWFJVKPAEFMZ-UHFFFAOYSA-N
SMILES O(CCCCCCCCCCCCCCCCCC)C(=O)C(C)C
ChEBI Ontology
Outgoing Octadecyl isobutyrate (CHEBI:196298) is a carboxylic ester (CHEBI:33308)
IUPAC Name
octadecyl 2-methylpropanoate
Manual Xrefs Databases
487331 ChemSpider
LMFA07010678 LIPID MAPS
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