CHEBI:32111 - saccharin

Main ChEBI Ontology Automatic Xrefs
ChEBI Name saccharin
ChEBI ID CHEBI:32111
Definition A 1,2-benzisothiazole having a keto-group at the 3-position and two oxo substituents at the 1-position. It is used as an artificial sweetening agent.
Stars This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs CHEBI:49717
Supplier Information
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Formula C7H5NO3S
Net Charge 0
Average Mass 183.18500
InChI InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)
InChIKey CVHZOJJKTDOEJC-UHFFFAOYSA-N
SMILES O=C1NS(=O)(=O)c2ccccc12
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role(s): sweetening agent
Substance that sweeten food, beverages, medications, etc.
xenobiotic
A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Application(s): sweetening agent
Substance that sweeten food, beverages, medications, etc.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing saccharin (CHEBI:32111) has role environmental contaminant (CHEBI:78298)
saccharin (CHEBI:32111) has role sweetening agent (CHEBI:50505)
saccharin (CHEBI:32111) has role xenobiotic (CHEBI:35703)
saccharin (CHEBI:32111) is a 1,2-benzisothiazole (CHEBI:55505)
saccharin (CHEBI:32111) is a lactam (CHEBI:24995)
saccharin (CHEBI:32111) is a sulfone (CHEBI:35850)
Incoming probenazole (CHEBI:81778) has functional parent saccharin (CHEBI:32111)
IUPAC Name
1,2-benzisothiazol-3(2H)-one 1,1-dioxide
Synonyms Sources
1,1-Dioxo-1,2-benzisothiazol-3(2H)-one NIST Chemistry WebBook
1,1-Dioxo-1,2-dihydro-benzo[d]isothiazol-3-one NIST Chemistry WebBook
1,2-Benzisothiazol-3(2H)-one 1,1-dioxide ChemIDplus
1,2-Benzisothiazolin-3-one 1,1-dioxide NIST Chemistry WebBook
1,2-Dihydro-2-ketobenzisosulfonazole ChemIDplus
1,2-Dihydro-2-ketobenzisosulphonazole ChemIDplus
2,3-Dihydro-3-oxobenzisosulfonazole ChemIDplus
2,3-Dihydro-3-oxobenzisosulphonazole ChemIDplus
3-Hydroxybenzisothiazole-S,S-dioxide ChemIDplus
Anhydro-o-sulfaminebenzoic acid ChemIDplus
Benzo-2-sulphimide ChemIDplus
Benzoic acid sulfimide ChemIDplus
Benzoic sulfimide ChemIDplus
Benzoic sulphimide ChemIDplus
Benzosulfimide ChemIDplus
Benzosulphimide ChemIDplus
Benzoylsulfonic Imide ChemIDplus
o-Benzoic sulfimide ChemIDplus
o-Benzosulfimide ChemIDplus
o-Sulfobenzimide ChemIDplus
o-Sulfobenzoic acid imide ChemIDplus
Saccharimide ChemIDplus
Saccharin KEGG DRUG
Saccharine ChemIDplus
Database Links Databases
CPD-5581 MetaCyc
D01085 KEGG DRUG
HMDB29723 HMDB
LSA PDBeChem
Saccharin Wikipedia
View more database links
Registry Numbers Types Sources
4203 Gmelin Registry Number Gmelin
6888 Beilstein Registry Number Beilstein
6888 Reaxys Registry Number Reaxys
81-07-2 CAS Registry Number KEGG DRUG
81-07-2 CAS Registry Number ChemIDplus
81-07-2 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
24456165 PubMed citation CiteXplore
24549104 PubMed citation CiteXplore
24739358 PubMed citation CiteXplore
24780866 PubMed citation CiteXplore
Last Modified
08 December 2014