CHEBI:188074 - rosiglitazone(1−)

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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 rosiglitazone(1−)
ChEBI ID CHEBI:188074
ChEBI ASCII Name rosiglitazone(1-)
Stars This entity has been manually annotated by a third party.
Submitter Elisabeth COUDERT
Supplier Information
Download Molfile XML SDF
Formula C18H18N3O3S
Net Charge -1
Average Mass 356.420
Monoisotopic Mass 356.10744
InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)/p-1
InChIKey YASAKCUCGLMORW-UHFFFAOYSA-M
SMILES C1=CC(=CC=C1CC2C([N-]C(S2)=O)=O)OCCN(C)C=3N=CC=CC3
ChEBI Ontology
Outgoing rosiglitazone(1−) (CHEBI:188074) is a thiazolidinediones (CHEBI:50990)
rosiglitazone(1−) (CHEBI:188074) is conjugate base of rosiglitazone (CHEBI:50122)
Incoming rosiglitazone (CHEBI:50122) is conjugate acid of rosiglitazone(1−) (CHEBI:188074)
Synonym Source
rosiglitazone UniProt