EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:183612 - Byrsonic acid

Default Structure
ChEBI IDCHEBI:183612
ChEBI NameByrsonic acid
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC26H48O6
Net Charge0
Average Mass456.664
Monoisotopic Mass456.34509
SMILESCCCCCCCCCCCCCCC[C@H](CCC[C@H](CC(=O)O)OC(C)=O)OC(C)=O
InChIInChI=1S/C26H48O6/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18-24(31-22(2)27)19-17-20-25(21-26(29)30)32-23(3)28/h24-25H,4-21H2,1-3H3,(H,29,30)/t24-,25-/m1/s1
InChIKeyZHSKWVYVCJTAJW-JWQCQUIFSA-N
Species of MetaboliteComponentSourceComments
Ganoderma lucidum (ncbitaxon:5315)
primordium (BTO:0001886) MetaboLights (MTBLS3577)
fruit body (BTO:0000487) MetaboLights (MTBLS3577)
ChEBI Ontology
Outgoing Relation(s)
Byrsonic acid (CHEBI:183612) is a carbonyl compound (CHEBI:36586)
IUPAC Name 
(3R,7R)-3,7-diacetyloxydocosanoic acid
Manual XrefsDatabases
113369114ChemSpider
LMFA01050424LIPID MAPS