CHEBI:9329 - sulfadoxine

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ChEBI Name sulfadoxine
ChEBI ID CHEBI:9329
Definition A sulfonamide consisting of pyrimidine having methoxy substituents at the 5- and 6-positions and a 4-aminobenzenesulfonamido group at the 4-position. In combination with the antiprotozoal pyrimethamine (CHEBI:8673) it is used as an antimalarial.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C12H14N4O4S
Net Charge 0
Average Mass 310.33012
Monoisotopic Mass 310.074
InChI InChI=1S/C12H14N4O4S/c1-19-10-11(14-7-15-12(10)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)
InChIKey PJSFRIWCGOHTNF-UHFFFAOYSA-N
SMILES COc1ncnc(NS(=O)(=O)c2ccc(N)cc2)c1OC
Roles Classification
Biological Role(s): antibacterial drug
A drug used to treat or prevent bacterial infections.
antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
Application(s): antibacterial drug
A drug used to treat or prevent bacterial infections.
antimalarial
A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.
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ChEBI Ontology
Outgoing sulfadoxine (CHEBI:9329) has role antibacterial drug (CHEBI:36047)
sulfadoxine (CHEBI:9329) has role antimalarial (CHEBI:38068)
sulfadoxine (CHEBI:9329) is a pyrimidines (CHEBI:39447)
sulfadoxine (CHEBI:9329) is a sulfonamide (CHEBI:35358)
IUPAC Name
4-amino-N-(5,6-dimethoxypyrimidin-4-yl)benzenesulfonamide
INNs Sources
sulfadoxina ChemIDplus
sulfadoxine KEGG DRUG
sulfadoxinum ChemIDplus
Synonyms Sources
4-Sulfanilamido-5,6-dimethoxypyrimidine ChemIDplus
Sulfadoxine KEGG COMPOUND
Sulforthomidine ChemIDplus
Sulphadoxine ChemIDplus
Sulphormethoxine ChemIDplus
Manual Xrefs Databases
1784 VSDB
2503 DrugCentral
C07630 KEGG COMPOUND
D00580 KEGG DRUG
DB01299 DrugBank
LSM-5657 LINCS
Sulfadoxine Wikipedia
View more database links
Registry Numbers Types Sources
2447-57-6 CAS Registry Number ChemIDplus
625453 Beilstein Registry Number Beilstein
625453 Reaxys Registry Number Reaxys
Citations Waiting for Citations Types Sources
11431418 PubMed citation Europe PMC
14711594 PubMed citation Europe PMC
23183348 PubMed citation Europe PMC
Last Modified
22 February 2017