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CHEBI:188734 - Methyl (2E)-2-(1-hydroxy-2-oxopropyl)-2-hexadecenoate

Default Structure
ChEBI IDCHEBI:188734
ChEBI NameMethyl (2E)-2-(1-hydroxy-2-oxopropyl)-2-hexadecenoate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC20H36O4
Net Charge0
Average Mass340.504
Monoisotopic Mass340.26136
SMILESCCCCCCCCCCCCC/C=C(/C(=O)OC)C(O)C(C)=O
InChIInChI=1S/C20H36O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-18(20(23)24-3)19(22)17(2)21/h16,19,22H,4-15H2,1-3H3/b18-16+
InChIKeyGRBBECUHXQCEBW-FBMGVBCBSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
Methyl (2E)-2-(1-hydroxy-2-oxopropyl)-2-hexadecenoate (CHEBI:188734) is a long-chain fatty alcohol (CHEBI:17135)
IUPAC Name 
methyl (E)-2-(1-hydroxy-2-oxopropyl)hexadec-2-enoate
Manual XrefsDatabases
4946312ChemSpider
Registry NumbersSources
CAS:176654-13-0ChemIDplus