CHEBI:169381 - N-Desmethyl-O-hydroxy rosiglitazone

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ChEBI Name N-Desmethyl-O-hydroxy rosiglitazone
ChEBI ID CHEBI:169381
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
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Formula C17H17N3O4S
Net Charge 0
Average Mass 359.400
Monoisotopic Mass 359.09398
InChI InChI=1S/C17H17N3O4S/c21-13-2-1-7-18-15(13)19-8-9-24-12-5-3-11(4-6-12)10-14-16(22)20-17(23)25-14/h1-7,14,21H,8-10H2,(H,18,19)(H,20,22,23)
InChIKey GWVBGLUFILBNNY-UHFFFAOYSA-N
SMILES S1C(CC2=CC=C(OCCNC=3N=CC=CC3O)C=C2)C(=O)NC1=O
Metabolite of Species Details
Malus domestica (NCBI:txid3750) Found in exocarp (BTO:0000733). of strain Malus x domestica Borkh. cv. Ruixue See: MetaboLights Study
ChEBI Ontology
Outgoing N-Desmethyl-O-hydroxy rosiglitazone (CHEBI:169381) is a aromatic ether (CHEBI:35618)
IUPAC Name
5-[[4-[2-[(3-hydroxypyridin-2-yl)amino]ethoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
Manual Xrefs Databases
32702400 ChemSpider
HMDB0060836 HMDB
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Registry Number Type Source
257892-32-3 CAS Registry Number ChemIDplus