Saccharin - PubChem Public Chemical Database

Saccharin - Substance Summary (SID 197310)

Flavoring agent and non-nutritive sweetener.

Table of Contents

Drug and Chemical Information

Pharmacological Action

Pharmacological Classification

Chemical Classification

Safety and Toxicology

Substance Information

Exports

Drug and Chemical Information: (Total:1)

Saccharin

Pharmacological Action

Sweetening Agents - Substances that sweeten food, beverages, medications, etc., such as sugar, saccharine or other low-calorie synthetic products. (From Random House Unabridged Dictionary, 2d ed)

Pharmacological Classification

Chemical Actions and Uses

Specialty Uses of Chemicals

Flavoring Agents

Sweetening Agents

Chemical Classification

Heterocyclic Compounds

Heterocyclic Compounds, 1-Ring

Azoles

Thiazoles

Benzothiazoles

Saccharin

Heterocyclic Compounds, 2-Ring

Benzothiazoles

Saccharin

Organic Chemicals

Sulfur Compounds

Thiazoles

Saccharin

Safety and Toxicology

HSDB - Peer-reviewed summary of toxicity and biomedical effects

NJ-HSFS - New Jersey Material Data Safety Sheets

CCRIS - Carcinogenicity, tumor promotion, tumor inhibition, and mutagenicity tests

EINECS - European Inventory of Existing Commercial Chemical Substances

GENETOX - Genetic toxicology information

TOXLINE - Citations to the toxicological literature

NTP DBS - Toxicological assay results

Household Products - Information on household products containing a chemical

Literature Choose by Subheadings:

administration and dosage	adverse effects	analogs and derivatives
analysis	antagonists and inhibitors	blood
chemical synthesis	chemistry	classification
diagnostic use	economics	genetics
history	immunology	isolation and purification
metabolism	pharmacokinetics	pharmacology
physiology	poisoning	radiation effects
standards	supply and distribution	therapeutic use
toxicity	urine

Literature Keyword Mining Tool

Data Source:

Depositor: ChemIDplus
External ID: 000128449

Properties Computed from Structure:

Molecular Weight	205.16633 [g/mol]
Molecular Formula	C₇H₄NNaO₃S
H-Bond Donor	0
H-Bond Acceptor	4
Rotatable Bond Count	0
Exact Mass	204.980958
MonoIsotopic Mass	204.980958
Topological Polar Surface Area	52.2
Heavy Atom Count	13
Formal Charge	0
Complexity	308
Isotope Atom Count	0
Defined Atom StereoCenter Count	0
Undefined Atom StereoCenter Count	0
Defined Bond StereoCenter Count	0
Undefined Bond StereoCenter Count	0
Covalently-Bonded Unit Count	2

Descriptors Computed from Structure:

IUPAC Name: sodium 1,1-dioxo-1,2-benzothiazol-2-id-3-one
Canonical SMILES: C1=CC=C2C(=C1)C(=O)[N-]S2(=O)=O.[Na+]
InChI: InChI=1S/C7H5NO3S.Na/c9-7-5-3-1-2-4-6(5)12(10,11)8-7;/h1-4H,(H,8,
9);/q;+1/p-1

InChIKey: WINXNKPZLFISPD-UHFFFAOYSA-M

Substance Information:

SID 197310

Deposit Date: 2005-08-08
Modify Date: 2006-04-28

CID 656582

Create Date: 2005-06-24

Parent CID 5143

Unique Components: 2 Links

Related Substances:

Same: 10 Links

Similar Substances: 293 Links

ASN1