(3Z)-dodec-3-en-1-yl sulfate (CHEBI:82995)

ChEBI > Main

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name	(3Z)-dodec-3-en-1-yl sulfate

ChEBI ID	CHEBI:82995

Definition	An organosulfate oxoanion that is the conjugate base of (3Z)-dodec-3-en-1-yl hydrogen sulfate. It has been isolated from Daphnia pulex and has been shown to cause morphological changes in the green alga Scenedesmus gutwinskii.

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

Supplier Information

Download	Molfile XML SDF

Formula

C12H23O4S

Net Charge

-1

Average Mass

263.37400

Monoisotopic Mass

263.13225

InChI

InChI=1S/C12H24O4S/c1-2-3-4-5-6-7-8-9-10-11-12-16-17(13,14)15/h9-10H,2-8,11-12H2,1H3,(H,13,14,15)/p-1/b10-9-

InChIKey

OXZPGZPXSCUIQZ-KTKRTIGZSA-M

SMILES

CCCCCCCC\C=C/CCOS([O-])(=O)=O

Metabolite of Species	Details
Daphnia pulex (NCBI:txid6669)	See: 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 Role(s):	kairomone A semiochemical used for inter-species chemical communication in a way that benefits an individual of another species that receives the chemical signal. Daphnia pulex metabolite A Daphnia metabolite produced by the species Daphnia pulex.

ChEBI Ontology
Outgoing	(3Z)-dodec-3-en-1-yl sulfate (CHEBI:82995) has role Daphnia pulex metabolite (CHEBI:83075) (3Z)-dodec-3-en-1-yl sulfate (CHEBI:82995) has role kairomone (CHEBI:83074) (3Z)-dodec-3-en-1-yl sulfate (CHEBI:82995) is a organosulfate oxoanion (CHEBI:58958) (3Z)-dodec-3-en-1-yl sulfate (CHEBI:82995) is conjugate base of (3Z)-dodec-3-en-1-yl hydrogen sulfate (CHEBI:83083)

Incoming	(3Z)-dodec-3-en-1-yl hydrogen sulfate (CHEBI:83083) is conjugate acid of (3Z)-dodec-3-en-1-yl sulfate (CHEBI:82995)

IUPAC Name

(3Z)-dodec-3-en-1-yl sulfate

Registry Number	Type	Source
15864356	Reaxys Registry Number	Reaxys

Citation	Type	Source
18175994	PubMed citation	Europe PMC

Last Modified

23 September 2014