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CHEBI:169001 - Sorbitan laurate

ChEBI IDCHEBI:169001
ChEBI NameSorbitan laurate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H34O6
Net Charge0
Average Mass346.464
Monoisotopic Mass346.23554
SMILESCCCCCCCCCCCC(=O)OCC(O)C1OCC(O)C1O
InChIInChI=1S/C18H34O6/c1-2-3-4-5-6-7-8-9-10-11-16(21)23-13-15(20)18-17(22)14(19)12-24-18/h14-15,17-20,22H,2-13H2,1H3
InChIKeyLWZFANDGMFTDAV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Malus domestica (ncbitaxon:3750) exocarp (BTO:0000733) MetaboLights (MTBLS2384) Strain: Malus x domestica Borkh. cv. Ruixue
ChEBI Ontology
Outgoing Relation(s)
Sorbitan laurate (CHEBI:169001) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
[2-(3,4-dihydroxyoxolan-2-yl)-2-hydroxyethyl] dodecanoate
Manual XrefsDatabases
308317ChemSpider
HMDB0029885HMDB
LMFA07011017LIPID MAPS