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ChEBI
> Main
CHEBI:8892 - rosiglitazone maleate
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ChEBI Ontology
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ChEBI Name
rosiglitazone maleate
ChEBI ID
CHEBI:8892
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C18H19N3O3S.C4H4O4
Net Charge
0
Average Mass
473.50004
Monoisotopic Mass
473.12567
InChI
InChI=1S/C18H19N3O3S.C4H4O4/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;5-
3(6)
1-
2-
4(7)
8/h2-
9,15H,10-
12H2,1H3,(H,20,22,23)
;1-
2H,(H,5,6)
(H,7,8)
/b;2-
1-
InChIKey
SUFUKZSWUHZXAV-BTJKTKAUSA-N
SMILES
[H+].[H+].[O-]C(=O)\C=C/C([O-])=O.CN(CCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccccn1
ChEBI Ontology
Outgoing
rosiglitazone maleate (
CHEBI:8892
)
has part
rosiglitazone (
CHEBI:50122
)
rosiglitazone maleate (
CHEBI:8892
)
is a
maleate salt (
CHEBI:50221
)
IUPAC Name
5-
(4-
{2-
[methyl(pyridin-
2-
yl)amino]ethoxy}benzyl)-
1,3-
thiazolidine-
2,4-
dione (2
Z
)-
but-
2-
enedioic acid
Synonyms
Sources
BRL 49653C
ChemIDplus
rosiglitazone maleate
KEGG DRUG
Brand Name
Source
Avandia
DrugBank
Manual Xrefs
Databases
D00596
KEGG DRUG
DB00412
DrugBank
View more database links
Registry Numbers
Types
Sources
155141-29-0
CAS Registry Number
ChemIDplus
7966066
Beilstein Registry Number
Beilstein
Last Modified
04 November 2008