Promethazine sulfoxide (CHEBI:184090)

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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	Promethazine sulfoxide

ChEBI ID	CHEBI:184090

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C17H20N2OS

Net Charge

Average Mass

300.420

Monoisotopic Mass

300.12963

InChI

InChI=1S/C17H20N2OS/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)21(20)17-11-7-5-9-15(17)19/h4-11,13H,12H2,1-3H3

InChIKey

OWTCLFIFAFHQIX-UHFFFAOYSA-N

SMILES

S1(=O)C=2C(N(CC(N(C)C)C)C=3C1=CC=CC3)=CC=CC2

Metabolite of Species	Details
Mus musculus (NCBI:txid10090)	Found in small intestine (BTO:0000651). of strain C57BL/6 Mouse [THESAURUS.OWL#C14424] See: MetaboLights Study
Nippostrongylus brasiliensis (NCBI:txid27835)	Found in Whole Organism (THESAURUS.OWL#C13413). See: MetaboLights Study

ChEBI Ontology
Outgoing	Promethazine sulfoxide (CHEBI:184090) is a phenothiazines (CHEBI:38093)

IUPAC Name

N,N-dimethyl-1-(5-oxophenothiazin-10-yl)propan-2-amine