Betanin | CAS No. 7659-95-2

Betanin

Basic Information

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CAS Number

7659-95-2

Molecular Formula

C24H26N2O13

Molecular Weight

550.47 g/mol

EINECS

231-628-5

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Boiling Point

983.5±75.0 °C(Predicted)

Density

1.81±0.1 g/cm3(Predicted)

Flash Point

548.6 °C

SMILES

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OC[C@H]1O[C@@H](OC2=C(O)C=C3N(C=CC4=CC(=N[C@@H](C4)C(O)=O)C(O)=O)[C@@H](CC3=C2)C(O)=O)[C@H](O)[C@@H](O)[C@@H]1O

InChI

InChI=1S/C24H26N2O13/c27-8-17-18(29)19(30)20(31)24(39-17)38-16-6-10-5-14(23(36)37)26(13(10)7-15(16)28)2-1-9-3-11(21(32)33)25-12(4-9)22(34)35/h1-3,6-7,12,14,17-20,24,27-31H,4-5,8H2,(H,32,33)(H,34,35)(H,36,37)/t12-,14-,17+,18+,19-,20+,24+/m0/s1

InChIKey

CTMLKIKAUFEMLE-FMOSSLLZSA-N

LogP

-1.7907999999999982

pKa

-2.27±0.40(Predicted)

Topological Polar Surface Area

247.10999999999996 Å²

Hydrogen Bond Donor/Acceptor

8 / 15

Complexity

1060

Synonyms & References

English

BETANIN
(s-(r*,r*))--dihydro-6-hydroxy-1h-indol-1-yl)ethenyl)-3-dihydro-
2,6-pyridinedicarboxylicacid,4-(2-(2-carboxy-5-(beta-d-glucopyranosyloxy)-2,3
[S-(R*,R*)]-4-[2-[2-carboxy-5-(beta-D-glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indol-1-yl]vinyl]-2,3-dihydropyridine-2,6-dicarboxylic acid
2,6-Pyridinedicarboxylic acid, 4-2-(2S)-2-carboxy-5-(.beta.-D-glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indol-1-ylethenyl-2,3-dihydro-, (2S)-
(S-(R*,R*-(E,E)))-2-Carboxy-1-((2,6-dicarboxy-2,3-dihydro-4(1H)-pyridi nylidene)ethylidene)-5-(beta-D-glucopyranosyloxy)-2,3-dihydro-6-hydrox y-1H-indolium hydroxide, inner salt
Betanin (Red Beet extract diluted with Dextrin)
(2S)-4-[2-[(2S)-2-Carboxy-5-(β-D-glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indol-1-yl]ethenyl]-2,3-dihydro-2,6-pyridinedicarboxylic acid
Red Beet extract diluted with Dextrin
BETACYANINE
(Red Beet extract diluted with Dextrin)
(s-(r*,r*))--dihydro-6-hydroxy-1h-indol-1-yl)ethenyl)-3-dihydro
Beetroot Red
Phytolaccanin

MDL Number

MFCD00060076

EC Number

231-628-5

Customs Code

32041200

FAQ

What is Betanin (CAS: 7659-95-2)?

Betanin is a water-soluble red pigment found in plants, specifically in beets. It has a chemical formula of C15H11NO7. Betanin is characterized by its bright red color and is commonly used as a natural food coloring.

What are the main uses of Betanin (CAS: 7659-95-2)?

Betanin is primarily used as a natural food coloring, particularly in beverages, desserts, and candies. It is also used in the pharmaceutical industry for coloring capsules and tablets, and in cosmetics for adding color to products. Additionally, betanin is studied for its antioxidant and anti-inflammatory properties in research.

Is Betanin (CAS: 7659-95-2) safe?

Betanin is generally considered safe for food use. However, individuals with beet allergies or sensitivities may experience adverse reactions. It is important to follow safety guidelines and use appropriate protective measures when handling betanin.

How should Betanin (CAS: 7659-95-2) be stored?

Betanin should be stored in a cool, dry place, away from direct light and heat sources to maintain its stability. It is recommended to store it in a sealed container to prevent degradation. The optimal temperature for storage is between 15-25°C (59-77°F) and humidity should be kept below 60%.