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CHEBI:175869 - 1-Acetoxy-2-hydroxy-5,12,15-heneicosatrien-4-one

ChEBI IDCHEBI:175869
ChEBI Name1-Acetoxy-2-hydroxy-5,12,15-heneicosatrien-4-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC23H38O4
Net Charge0
Average Mass378.553
Monoisotopic Mass378.27701
SMILESCCCCC/C=C\C/C=C\CCCCC/C=C/C(=O)C[C@@H](O)COC(C)=O
InChIInChI=1S/C23H38O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22(25)19-23(26)20-27-21(2)24/h7-8,10-11,17-18,23,26H,3-6,9,12-16,19-20H2,1-2H3/b8-7-,11-10-,18-17+/t23-/m1/s1
InChIKeyYLWJMUPPJKELEC-RSWURYEXSA-N
ChEBI Ontology
Outgoing Relation(s)
1-Acetoxy-2-hydroxy-5,12,15-heneicosatrien-4-one (CHEBI:175869) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name 
[(2R,5E,12Z,15Z)-2-hydroxy-4-oxohenicosa-5,12,15-trienyl] acetate
Manual XrefsDatabases
8818752ChemSpider
HMDB0035273HMDB
LMFA05000596LIPID MAPS
Registry NumbersSources
CAS:287389-87-1ChemIDplus