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CHEBI:220361 - Panosialin A

ChEBI IDCHEBI:220361
ChEBI NamePanosialin A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H36O8S2
Net Charge0
Average Mass480.645
Monoisotopic Mass480.18516
SMILESCC(C)CCCCCCCCCCCCc1cc(OS(=O)(=O)O)cc(OS(=O)(=O)O)c1
InChIInChI=1S/C21H36O8S2/c1-18(2)13-11-9-7-5-3-4-6-8-10-12-14-19-15-20(28-30(22,23)24)17-21(16-19)29-31(25,26)27/h15-18H,3-14H2,1-2H3,(H,22,23,24)(H,25,26,27)
InChIKeyNGWLEVXPPLCHNC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomycesspecies (ncbitaxon:1931) - PubMed (5140534)
ChEBI Ontology
Outgoing Relation(s)
Panosialin A (CHEBI:220361) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
[3-(13-methyltetradecyl)-5-sulooxyphenyl] hydrogen sulate
Manual XrefsDatabases
8634882ChemSpider