Sucralose - ≥98% , CAS No.56038-13-2

CAS: 56038-13-2 Cat. No.: S107614 Fórmula: C₁₂H₁₉Cl₃O₈ Peso molecular: 397.63 Beilstein Registry Number: 3654410 Número CE: 259-952-2 PubChem CID: 71485

GRAU & PUREZA ≥98%

Synonyms

E955 | 4,1',6'-Trichloro-4,1',6'-trideoxy-galacto-sucrose | Biocoline | CCG-213995 | Sucrazit | CCRIS 8449 | Citric acid, trisodium salt | INS-955 | SUCRALOSE [II] | AKOS015962432 | alpha-D-Galactopyranoside, 1,6-dichloro-1,6-dideoxy-beta-D-fructofuranosy

Storage

Room temperature

Shipped In

Normal

Visão geral

Sucralose is a non-caloric sugar used as a sweetener that activates T1R2/T1R3 sweet taste receptors and modulates Glukagon-like peptide-1, glucose-dependent insulinotrophic peptide, and incretin secretion.

Especificações

Sinónimos

E955 | 4,1',6'-Trichloro-4,1',6'-trideoxy-galacto-sucrose | Biocoline | CCG-213995 | Sucrazit | CCRIS 8449 | Citric acid, trisodium salt | INS-955 | SUCRALOSE [II] | AKOS015962432 | alpha-D-Galactopyranoside, 1,6-dichloro-1,6-dideoxy-beta-D-fructofuranosy

Especificações e pureza

≥98%

Mecanismos bioquímicos e fisiológicos

A synthetic sweetener that can be detected by humans. It can activate the T1R2/T1R3 sweet taste receptors on intestinal endocrine cells, causing an increase in hormone secretion of glucagon like peptide-1 and glucose dependent insulin peptides.

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

488184657

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488184657

Sorrisos canónicos

C(C1C(C(C(C(O1)OC2(C(C(C(O2)CCl)O)O)CCl)O)O)Cl)O

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

InChIKey

BAQAVOSOZGMPRM-QBMZZYIRSA-N

INCHI

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

SMILES isoméricas

C([C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@]2([C@H]([C@@H]([C@H](O2)CCl)O)O)CCl)O)O)Cl)O

WGK Alemanha

3

RTECS

LW5440140

PubChem CID

71485

Peso molecular

397.63

Beilstein

3654410

Reaxy-Rn

3654410

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Carbohydrates and carbohydrate conjugates
        • Level5 Glycosyl compounds
          • Level6 C-glycosyl compounds

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Carbohydrates and carbohydrate conjugates
• Intermediate Tree Nodes: Glycosyl compounds
• Direct Parent: C-glycosyl compounds
• Alternative Parents: Ketals Oxanes Monosaccharides Tetrahydrofurans Secondary alcohols Chlorohydrins Oxacyclic compounds Primary alcohols Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: C-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
• Descrição: This 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.
• External Descriptors: organochlorine compound - disaccharide derivative

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Alvos associados (humanos)

CA2 Tclin Carbonic anhydrase 2 (1 Activities)

Discover Target: CA2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

CA2 Tclin Carbonic anhydrase II (17698 Activities)

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CA9 Tclin Carbonic anhydrase IX (8255 Activities)

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Homo sapiens (32628 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TAS2R31 Tchem Taste receptor type 2 member 31 (86 Activities)

Discover Target: TAS2R31

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TAS2R10 Tchem Taste receptor type 2 member 10 (51 Activities)

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HEK-293T (167025 Activities)

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TAS2R46 Tchem Taste receptor type 2 member 46 (155 Activities)

Discover Target: TAS2R46

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Alvos associados (não humanos)

Hdac6 Histone deacetylase 6 (222 Activities)

Discover Target: Hdac6

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rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

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SARS-CoV-2 (38078 Activities)

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Mecanismos de ação

Propriedades químicas e físicas

• Solubilidade: Soluble in Water.
• Rotação específica [α]: 86.0° (C=1,H2O)
• Ponto de fusão (°C): 130°C
• Peso molecular: 397.600 g/mol
• XLogP3: -1.500
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 5
• Exact Mass: 396.015 Da
• Monoisotopic Mass: 396.015 Da
• Topological Polar Surface Area: 129.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 405.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 9
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1