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CHEBI:218389 - Panosialin wD

ChEBI IDCHEBI:218389
ChEBI NamePanosialin wD
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SubmitterMetaboLights
DownloadsMolfile
FormulaC21H36O5S
Net Charge0
Average Mass400.581
Monoisotopic Mass400.22835
SMILESCCC[C@H](C)CCCCCCCCCCc1cc(O)cc(OS(=O)(=O)O)c1
InChIInChI=1S/C21H36O5S/c1-3-12-18(2)13-10-8-6-4-5-7-9-11-14-19-15-20(22)17-21(16-19)26-27(23,24)25/h15-18,22H,3-14H2,1-2H3,(H,23,24,25)/t18-/m0/s1
InChIKeyDTKXGPUQRVDFCG-SFHVURJKSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (7730153)
ChEBI Ontology
Outgoing Relation(s)
Panosialin wD (CHEBI:218389) is a aryl sulfate (CHEBI:37919)
IUPAC Name 
[3-hydroxy-5-(11-methyltetradecyl)phenyl] hydrogen sulate
Manual XrefsDatabases
78436021ChemSpider