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CHEBI:188692 - (4xi)-1,4-Anhydro-6-O-palmitoyl-D-xylo-hexitol

ChEBI IDCHEBI:188692
ChEBI Name(4xi)-1,4-Anhydro-6-O-palmitoyl-D-xylo-hexitol
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC22H42O6
Net Charge0
Average Mass402.572
Monoisotopic Mass402.29814
SMILESCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)C1OC[C@H](O)[C@H]1O
InChIInChI=1S/C22H42O6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20(25)27-17-19(24)22-21(26)18(23)16-28-22/h18-19,21-24,26H,2-17H2,1H3/t18-,19+,21+,22?/m0/s1
InChIKeyIYFATESGLOUGBX-RERQMSIWSA-N
Species of MetaboliteComponentSourceComments
Phyllostachys violascens (ncbitaxon:1903417) stem (BTO:0001300) MetaboLights (MTBLS3970) Strain: Phyllostachys violascens cv. Viridisulcata
ChEBI Ontology
Outgoing Relation(s)
(4xi)-1,4-Anhydro-6-O-palmitoyl-D-xylo-hexitol (CHEBI:188692) is a fatty acid ester (CHEBI:35748)
IUPAC Name 
[(2R)-2-[(3R,4S)-3,4-dihydroxyoxolan-2-yl]-2-hydroxyethyl] hexadecanoate
Manual XrefsDatabases
30791831ChemSpider
D05896KEGG DRUG