EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:169845 - Stearoyllactic acid

ChEBI IDCHEBI:169845
ChEBI NameStearoyllactic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H40O4
Net Charge0
Average Mass356.547
Monoisotopic Mass356.29266
SMILESCCCCCCCCCCCCCCCCCC(=O)OC(C)C(=O)O
InChIInChI=1S/C21H40O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20(22)25-19(2)21(23)24/h19H,3-18H2,1-2H3,(H,23,24)
InChIKeyQMGGUIASDZZMHS-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)
Stearoyllactic acid (CHEBI:169845) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
2-octadecanoyloxypropanoic acid
Manual XrefsDatabases
78181ChemSpider
HMDB0033372HMDB
LMFA07011021LIPID MAPS