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CHEBI:31343 - Calcium linoleate

ChEBI IDCHEBI:31343
ChEBI NameCalcium linoleate
Stars
Last Modified24 February 2022
DownloadsMolfile
Formula2C18H31O2.Ca
Net Charge0
Average Mass598.966
Monoisotopic Mass598.42740
SMILESCCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].CCCCC/C=C\C/C=C\CCCCCCCC(=O)[O-].[Ca+2]
InChIInChI=1S/2C18H32O2.Ca/c2*1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20;/h2*6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20);/q;;+2/p-2/b2*7-6-,10-9-;
InChIKeyROZZMLUWBPPEMU-GRVYQHKQSA-L
ChEBI Ontology
Outgoing Relation(s)
Calcium linoleate (CHEBI:31343) has part linoleate (CHEBI:30245)
Calcium linoleate (CHEBI:31343) is a organic calcium salt (CHEBI:51031)
Synonyms  Source
Calcium linoleateKEGG COMPOUND
Calcium 1-oxidooctadeca-9,12-dien-1-oneKEGG COMPOUND
Manual XrefsDatabases
D01928KEGG DRUG
Registry NumbersSources
CAS:19704-83-7KEGG COMPOUND