2-morpholinophenyl 1-methyl-1H-imidazole-4-sulfonate (CHEBI:183763)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.

ChEBI Name	2-morpholinophenyl 1-methyl-1H-imidazole-4-sulfonate

ChEBI ID	CHEBI:183763

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H17N3O4S

Net Charge

Average Mass

323.370

Monoisotopic Mass

323.09398

InChI

InChI=1S/C14H17N3O4S/c1-16-10-14(15-11-16)22(18,19)21-13-5-3-2-4-12(13)17-6-8-20-9-7-17/h2-5,10-11H,6-9H2,1H3

InChIKey

YIETXZDHTKEPAF-UHFFFAOYSA-N

SMILES

S(OC=1C(N2CCOCC2)=CC=CC1)(=O)(=O)C=3N=CN(C3)C

Metabolite of Species	Details
Bombus terrestris (NCBI:txid30195)	Found in hindgut (BTO:0000510). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in brain (BTO:0000142). See: MetaboLights Study
Bombus terrestris (NCBI:txid30195)	Found in hemolymph (BTO:0000572). See: MetaboLights Study

ChEBI Ontology
Outgoing	2-morpholinophenyl 1-methyl-1H-imidazole-4-sulfonate (CHEBI:183763) is a morpholines (CHEBI:38785)

IUPAC Name

(2-morpholin-4-ylphenyl) 1-methylimidazole-4-sulonate