Sucralose

Relevant Data

Food Additives Approved in the United States

Food Additives Approved by WHO:

General Information

Chemical nameSucralose
E No.E 955
INS.955
CAS number56038-13-2
GroupNo

From webgate.ec.europa.eu

Authorisation of the use of this additive in Food Additives

The additive is authorised to be used in the following category(ies):
category(ies) Individual restriction(s)/exception(s) footnote
  • Flavoured fermented milk products including heat-treated products (1.4)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/l , only energy-reduced products or with no added sugar
  • Edible ices (3)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 320 mg/kg , only energy-reduced or with no added sugar
  • Fruit and vegetables in vinegar, oil, or brine (4.2.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 180 mg/kg , only sweet-sour preserves of fruit and vegetables
  • Canned or bottled fruit and vegetables (4.2.3)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/kg , only fruit energy-reduced or with no added sugar
  • Fruit and vegetable preparations excluding compote (4.2.4.1)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/kg , only energy-reduced
  • Extra jam and extra jelly as defined by Directive 2001/113/EC (4.2.5.1)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/kg , only energy-reduced jams jellies and marmalades
  • 52 Maximum usable levels are expressed in free imide
  • Jam, jellies and marmalades and sweetened chestnut puree as defined by Directive 2001/113/EC (4.2.5.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/kg , only energy-reduced jams, jellies and marmalades
  • Cocoa and Chocolate products as covered by Directive 2000/36/EC (5.1)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 800 mg/kg , only energy-reduced or with no added sugar
  • Chewing gum (5.3)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 3000 mg/kg , only with no added sugar
  • Breakfast cereals (6.3)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/kg , only breakfast cereals with a fibre content of more than 15 %, and containing at least 20 % bran, energy reduced or with no added sugar
  • Fine bakery wares (7.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 800 mg/kg , only cornets and wafers, for ice-cream, with no added sugar

  • ML = 800 mg/kg , only essoblaten - wafer paper

  • ML = 700 mg/kg , only fine bakery products for special nutritional uses
  • Processed fish and fisheries products including molluscs and crustaceans (9.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 120 mg/kg , only sweet-sour preserves and semi-preserves of fish and marinades of fish, crustaceans and molluscs
  • Table-Top Sweeteners in liquid form (11.4.1)(legislation:1129/2011, applicable as from 01/06/2013)

  • Table-Top Sweeteners in powder form (11.4.2)(legislation:1129/2011, applicable as from 01/06/2013)

  • Table-Top Sweeteners in tablets (11.4.3)(legislation:1129/2011, applicable as from 01/06/2013)
  • quantum satis
  • Mustard (12.4)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 140 mg/kg
  • Soups and broths (12.5)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 45 mg/kg , only energy-reduced soups
  • Sauces (12.6)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 450 mg/kg
  • Salads and savoury-based sandwich spreads (12.7)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 140 mg/kg , only Feinkostsalat
  • Dietary foods for special medical purposes defined in Directive 1999/21/EC (excluding products from food category 13.1.5) (13.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/kg
  • Dietary foods for weight control diets intended to replace total daily food intake or an individual meal (the whole or part of the total daily diet) (13.3)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 320 mg/kg
  • Fruit nectars as defined by Directive 2001/112/EC and vegetable nectars and similar products (14.1.3)(legislation:1129/2011, applicable as from 01/06/2013)

  • Flavoured drinks (14.1.4)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 300 mg/l , only energy-reduced or with no added sugar
  • Cider and perry (14.2.3)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 50 mg/l
  • Other alcoholic drinks including mixtures of alcoholic drinks with non-alcoholic drinks and spirits with less than 15 % of alcohol (14.2.8)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 250 mg/l
  • Potato-, cereal-, flour- or starch-based snacks (15.1)(legislation:1129/2011, applicable as from 01/06/2013)

  • Processed nuts (15.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 200 mg/kg
  • Desserts excluding products covered in category 1, 3 and 4 (16)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 400 mg/kg , only energy-reduced or with no added sugar
  • Food supplements supplied in a solid form including capsules and tablets and similar forms, excluding chewable forms (17.1)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 800 mg/kg
  • Food supplements supplied in a liquid form (17.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 240 mg/l
  • Food supplements supplied in a syrup-type or chewable form (17.3)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 2400 mg/kg
  • Other confectionery including breath refreshening microsweets (5.2)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 800 mg/kg , only cocoa or dried-fruit-based, energy-reduced or with no added sugar

  • ML = 1000 mg/kg , only strongly flavoured freshening throat pastilles with no added sugar

  • ML = 2400 mg/kg , only breath-freshening micro-sweets, with no added sugar

  • ML = 1000 mg/kg , only confectionery with no added sugar

  • ML = 1000 mg/kg , only starch based confectionery energy-reduced or with no added sugar

  • ML = 400 mg/kg , only cocoa, milk, dried fruit or fat based sandwich spreads, energy-reduced or with no added sugar

  • ML = 200 mg/kg , only energy-reduced tablet form confectionery
  • Decorations, coatings and fillings, except fruit-based fillings covered by category 4.2.4 (5.4)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 1000 mg/kg , only starch-based confectionery energy-reduced or with no added sugar

  • ML = 450 mg/kg , only sauces

  • ML = 800 mg/kg , only cocoa or dried fruit based, energy-reduced or with no added sugar

  • ML = 1000 mg/kg , only confectionery with no added sugar
  • Other similar fruit or vegetable spreads (4.2.5.3)(legislation:913/2013, applicable as from 14/10/2013)
  • ML = 400 mg/kg ,  only energy-reduced fruit or vegetable spreads and dried-fruit-based sandwich spreads, energy-reduced or with no added sugar
  • Beer and malt beverages (14.2.1)(legislation:1129/2011, applicable as from 01/06/2013)
  • ML = 250 mg/l , only alcohol-free beer or with an alcohol content not exceeding 1,2 % vol; 'Bière de table/Tafelbier/Table beer' (original wort content less than 6 %) except for 'Obergäriges Einfachbier'; Beers with a minimum acidity of 30 milli-equivalents expressed as NaOH; Brown beers of the 'oud bruin' type

  • ML = 10 mg/l , only energy-reduced beer

From webgate.ec.europa.eu

Computed Descriptors

Download SDF
2D Structure
CID71485
IUPAC Name(2R,3R,4R,5R,6R)-2-[(2R,3S,4S,5S)-2,5-bis(chloromethyl)-3,4-dihydroxyoxolan-2-yl]oxy-5-chloro-6-(hydroxymethyl)oxane-3,4-diol
InChIInChI=1S/C12H19Cl3O8/c13-1-4-7(17)10(20)12(3-14,22-4)23-11-9(19)8(18)6(15)5(2-16)21-11/h4-11,16-20H,1-3H2/t4-,5-,6+,7-,8+,9-,10+,11-,12+/m1/s1
InChI KeyBAQAVOSOZGMPRM-QBMZZYIRSA-N
Canonical SMILESC(C1C(C(C(C(O1)OC2(C(C(C(O2)CCl)O)O)CCl)O)O)Cl)O
Molecular FormulaC12H19Cl3O8
Wikipediasucralose

From Pubchem

Computed Properties

Property Name Property Value
Molecular Weight397.626
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Complexity405.0
CACTVS Substructure Key Fingerprint A A A D c e B w P A A G A A A A A A A A A A A A A A A A A S A A A A A k A A A A A A A A A A A A A A A A G g I A C A A A C B e w g E M A C A A A B g A A A A A A A A A A A A A A A A A A A A A A A w A R E A I B A A A i Q A A F A A A H A A H A Y A w A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A A = =
Topological Polar Surface Area129.0
Monoisotopic Mass396.015
Exact Mass396.015
Compound Is CanonicalizedTrue
Formal Charge0
Heavy Atom Count23
Defined Atom Stereocenter Count9
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Isotope Atom Count0
Covalently-Bonded Unit Count1

From Pubchem

ADMET Predicted Profile --- Classification

Model Result Probability
Absorption
Blood-Brain BarrierBBB+0.9216
Human Intestinal AbsorptionHIA-0.7204
Caco-2 PermeabilityCaco2-0.7622
P-glycoprotein SubstrateNon-substrate0.6626
P-glycoprotein InhibitorNon-inhibitor0.8819
Non-inhibitor0.9381
Renal Organic Cation TransporterNon-inhibitor0.8002
Distribution
Subcellular localizationMitochondria0.8061
Metabolism
CYP450 2C9 SubstrateNon-substrate0.8902
CYP450 2D6 SubstrateNon-substrate0.8374
CYP450 3A4 SubstrateNon-substrate0.6357
CYP450 1A2 InhibitorNon-inhibitor0.8164
CYP450 2C9 InhibitorNon-inhibitor0.8819
CYP450 2D6 InhibitorNon-inhibitor0.8865
CYP450 2C19 InhibitorNon-inhibitor0.7114
CYP450 3A4 InhibitorNon-inhibitor0.9491
CYP Inhibitory PromiscuityLow CYP Inhibitory Promiscuity0.8360
Excretion
Toxicity
Human Ether-a-go-go-Related Gene InhibitionWeak inhibitor0.9473
Non-inhibitor0.8618
AMES ToxicityNon AMES toxic0.7257
CarcinogensNon-carcinogens0.9244
Fish ToxicityHigh FHMT0.5970
Tetrahymena Pyriformis ToxicityHigh TPT0.9629
Honey Bee ToxicityHigh HBT0.6873
BiodegradationNot ready biodegradable0.9769
Acute Oral ToxicityIII0.4614
Carcinogenicity (Three-class)Non-required0.5296

From admetSAR

ADMET Predicted Profile --- Regression

Model Value Unit
Absorption
Aqueous solubility-1.4586LogS
Caco-2 Permeability-0.1389LogPapp, cm/s
Distribution
Metabolism
Excretion
Toxicity
Rat Acute Toxicity1.9394LD50, mol/kg
Fish Toxicity1.6975pLC50, mg/L
Tetrahymena Pyriformis Toxicity0.2125pIGC50, ug/L

From admetSAR

Taxonomic Classification

KingdomOrganic compounds
SuperclassOrganic oxygen compounds
ClassOrganooxygen compounds
SubclassCarbohydrates and carbohydrate conjugates
Intermediate Tree NodesGlycosyl compounds
Direct ParentC-glycosyl compounds
Alternative Parents
Molecular FrameworkAliphatic heteromonocyclic compounds
SubstituentsC-glycosyl compound - Ketal - Oxane - Monosaccharide - Tetrahydrofuran - Secondary alcohol - Chlorohydrin - Halohydrin - Acetal - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Organohalogen compound - Organochloride - Primary alcohol - Alkyl halide - Alkyl chloride - Alcohol - Aliphatic heteromonocyclic compound
DescriptionThis compound belongs to the class of organic compounds known as c-glycosyl compounds. These are glycoside in which a sugar group is bonded through one carbon to another group via a C-glycosidic bond.

From ClassyFire