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CHEBI:82991 - 7-methyloctyl sulfate

ChEBI IDCHEBI:82991
ChEBI Name7-methyloctyl sulfate
Stars
DefinitionAn organosulfate oxoanion that is the conjugate base of 7-methyloctyl hydrogen sulfate. It has been isolated from Daphnia pulex and has been shown to cause morphological changes in the green alga Scenedesmus gutwinskii.
Last Modified23 September 2014
DownloadsMolfile
FormulaC9H19O4S
Net Charge-1
Average Mass223.314
Monoisotopic Mass223.10095
SMILESCC(C)CCCCCCOS(=O)(=O)[O-]
InChIInChI=1S/C9H20O4S/c1-9(2)7-5-3-4-6-8-13-14(10,11)12/h9H,3-8H2,1-2H3,(H,10,11,12)/p-1
InChIKeyARACXKCAGMFROY-UHFFFAOYSA-M
Species of MetaboliteComponentSourceComments
Daphnia pulex (ncbitaxon:6669) - Article (Isolation of New Aliphatic Sulfates and Sulfamate as the Daphnia Kairomones Inducing Morphological Change of a Phytoplankton Scenedesmus gutwinskii Ko YASUMOTO, Akinori NISHIGAMI, Hiroaki AOI, Chise TSUCHIHASHI, Fumie KASAI,Takenori KUSUMI, and Takashi OOI Chem. Pharm. Bull. 56(1) 133- 136 (2008))
Roles Classification
Biological Roles:
Daphnia pulex metabolite  A Daphnia metabolite produced by the species Daphnia pulex.
kairomone  A semiochemical used for inter-species chemical communication in a way that benefits an individual of another species that receives the chemical signal.
ChEBI Ontology
Outgoing Relation(s)
7-methyloctyl sulfate (CHEBI:82991) has role Daphnia pulex metabolite (CHEBI:83075)
7-methyloctyl sulfate (CHEBI:82991) has role kairomone (CHEBI:83074)
7-methyloctyl sulfate (CHEBI:82991) is a organosulfate oxoanion (CHEBI:58958)
7-methyloctyl sulfate (CHEBI:82991) is conjugate base of 7-methyloctyl hydrogen sulfate (CHEBI:83073)
Incoming Relation(s)
7-methyloctyl hydrogen sulfate (CHEBI:83073) is conjugate acid of 7-methyloctyl sulfate (CHEBI:82991)
IUPAC Name 
7-methyloctyl sulfate
Registry NumbersSources
Reaxys:15864345Reaxys
Citations