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CHEBI:85381 - sodium 8-methoxypyrene-1,3,6-trisulfonate

Default Structure
ChEBI IDCHEBI:85381
ChEBI Namesodium 8-methoxypyrene-1,3,6-trisulfonate
Stars
DefinitionAn organic sodium salt that is the trisodium salt of 8-methoxypyrene-1,3,6-trisulfonic acid. A highly water-soluble superpolar fluorescent probe for assaying cationic surfactants.
Last Modified17 January 2019
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC17H9O10S3.3Na
Net Charge0
Average Mass538.420
Monoisotopic Mass537.90509
SMILESCOc1cc(S(=O)(=O)[O-])c2ccc3c(S(=O)(=O)[O-])cc(S(=O)(=O)[O-])c4ccc1c2c43.[Na+].[Na+].[Na+]
InChIInChI=1S/C17H12O10S3.3Na/c1-27-12-6-13(28(18,19)20)9-4-5-11-15(30(24,25)26)7-14(29(21,22)23)10-3-2-8(12)16(9)17(10)11;;;/h2-7H,1H3,(H,18,19,20)(H,21,22,23)(H,24,25,26);;;/q;3*+1/p-3
InChIKeyGUGNSJAORJLKGP-UHFFFAOYSA-K
Roles Classification
Application:
fluorescent probe  A role played by a fluorescent molecular entity used to study the microscopic environment by fluorescence spectroscopy.
ChEBI Ontology
Outgoing Relation(s)
sodium 8-methoxypyrene-1,3,6-trisulfonate (CHEBI:85381) has part 8-methoxypyrene-1,3,6-trisulfonate (CHEBI:85380)
sodium 8-methoxypyrene-1,3,6-trisulfonate (CHEBI:85381) has role fluorescent probe (CHEBI:39442)
sodium 8-methoxypyrene-1,3,6-trisulfonate (CHEBI:85381) is a organic sodium salt (CHEBI:38700)
Synonym  Source
8-methoxypyrene-1,3,6-trisulfonic acid trisodium saltChEBI
Registry NumbersSources
Reaxys:6469451Reaxys
CAS:82962-86-5ChEBI