(4R)-4,8-dimethylnonyl hydrogen sulfate (CHEBI:83112)

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ChEBI Name	(4R)-4,8-dimethylnonyl hydrogen sulfate

ChEBI ID	CHEBI:83112

ChEBI ASCII Name	(4R)-4,8-dimethylnonyl hydrogen sulfate

Definition	An alkyl sulfate that is the sulfuric ester of (4R)-4,8-dimethylnonan-1-ol.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C11H24O4S

Net Charge

Average Mass

252.37100

Monoisotopic Mass

252.13953

InChI

InChI=1S/C11H24O4S/c1-10(2)6-4-7-11(3)8-5-9-15-16(12,13)14/h10-11H,4-9H2,1-3H3,(H,12,13,14)/t11-/m1/s1

InChIKey

FCHHMBXKFHPMFQ-LLVKDONJSA-N

SMILES

CC(C)CCC[C@@H](C)CCCOS(O)(=O)=O

Roles Classification
Biological Role(s):	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	(4R)-4,8-dimethylnonyl hydrogen sulfate (CHEBI:83112) has role Daphnia pulex metabolite (CHEBI:83075) (4R)-4,8-dimethylnonyl hydrogen sulfate (CHEBI:83112) has role kairomone (CHEBI:83074) (4R)-4,8-dimethylnonyl hydrogen sulfate (CHEBI:83112) is a alkyl sulfate (CHEBI:29281) (4R)-4,8-dimethylnonyl hydrogen sulfate (CHEBI:83112) is conjugate acid of (4R)-4,8-dimethylnonyl sulfate (CHEBI:83014)

Incoming	(4R)-4,8-dimethylnonyl sulfate (CHEBI:83014) is conjugate base of (4R)-4,8-dimethylnonyl hydrogen sulfate (CHEBI:83112)

IUPAC Name

(4R)-4,8-dimethylnonyl hydrogen sulfate

Last Modified

23 September 2014