CHEBI:172565 - N-desmethylrosiglitazone

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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 N-desmethylrosiglitazone
ChEBI ID CHEBI:172565
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H17N3O3S
Net Charge 0
Average Mass 343.400
Monoisotopic Mass 343.09906
InChI InChI=1S/C17H17N3O3S/c21-16-14(24-17(22)20-16)11-12-4-6-13(7-5-12)23-10-9-19-15-3-1-2-8-18-15/h1-8,14H,9-11H2,(H,18,19)(H,20,21,22)
InChIKey ZJQTVMXUIGXRMR-UHFFFAOYSA-N
SMILES S1C(CC2=CC=C(OCCNC=3N=CC=CC3)C=C2)C(=O)NC1=O
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in blood plasma (BTO:0000131). See: MetaboLights Study
ChEBI Ontology
Outgoing N-desmethylrosiglitazone (CHEBI:172565) is a aromatic ether (CHEBI:35618)
IUPAC Name
5-[[4-[2-(pyridin-2-ylamino)ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Manual Xrefs Databases
10172795 ChemSpider
HMDB0060980 HMDB
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Registry Number Type Source
257892-31-2 CAS Registry Number ChemIDplus