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CHEBI:750643 - calcium undecylenate

Default Structure
ChEBI IDCHEBI:750643
ChEBI Namecalcium undecylenate
Stars
Last Modified29 June 2026
Submitterchembl-etl
DownloadsMolfile
FormulaC11H19O2.C11H19O2.Ca
Net Charge0
Average Mass406.620
Monoisotopic Mass406.23960
SMILESC=CCCCCCCCCC(=O)[O-].C=CCCCCCCCCC(=O)[O-].[Ca+2]
InChIInChI=1S/2C11H20O2.Ca/c2*1-2-3-4-5-6-7-8-9-10-11(12)13;/h2*2H,1,3-10H2,(H,12,13);/q;;+2/p-2
InChIKeyCLOKKBBIKHZGNX-UHFFFAOYSA-L
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
calcium undecylenate (CHEBI:750643) is a medium-chain fatty acid (CHEBI:59554)
Synonyms  Source
Calcium undecenoateChEMBL
Calcium undecylenateChEMBL
CruexChEMBL
Undecylenate calciumChEMBL