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CHEBI:171783 - 1-Acetoxy-2-hydroxy-16-heptadecyn-4-one

Default Structure
ChEBI IDCHEBI:171783
ChEBI Name1-Acetoxy-2-hydroxy-16-heptadecyn-4-one
Stars
Last Modified14 March 2023
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H32O4
Net Charge0
Average Mass324.461
Monoisotopic Mass324.23006
SMILESC#CCCCCCCCCCCCC(=O)CC(O)COC(C)=O
InChIInChI=1S/C19H32O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-18(21)15-19(22)16-23-17(2)20/h1,19,22H,4-16H2,2H3
InChIKeyHZHSVQVECJXVRP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606)
Pooled sample (NCIT:C45910) MetaboLights (MTBLS2128)
blood plasma (BTO:0000131) MetaboLights (MTBLS2128)
ChEBI Ontology
Outgoing Relation(s)
1-Acetoxy-2-hydroxy-16-heptadecyn-4-one (CHEBI:171783) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name 
(2-hydroxy-4-oxoheptadec-16-ynyl) acetate
Synonym  Source
UNII:74D1OHC38HChEBI
Manual XrefsDatabases
5142913ChemSpider
HMDB0031007HMDB
LMFA05000595LIPID MAPS
Registry NumbersSources
CAS:24607-10-1ChemIDplus