betanin
Names
[ CAS No. ]: 
7659-95-2
        
[ Name ]: 
betanin
        
[Synonym ]:
                
                (s-(r*,r*))--dihydro-6-hydroxy-1h-indol-1-yl)ethenyl)-3-dihydro
                
                
            
                
                (Red Beet extract diluted with Dextrin)
                
                
            
                
                Phytolaccanin
                
                
            
                
                (2S)-4-{2-[(2S)-2-Carboxy-5-(β-D-glucopyranosyloxy)-6-hydroxy-2,3-dihydro-1H-indol-1-yl]vinyl}-2,3-dihydro-2,6-pyridinedicarboxylic acid
                
                
            
                
                Beetroot Red
                
                
            
                
                EINECS 231-628-5
                
                
            
                
                2,6-Pyridinedicarboxylic acid, 4-[2-[(2S)-2-carboxy-5-(β-D-glucopyranosyloxy)-2,3-dihydro-6-hydroxy-1H-indol-1-yl]ethenyl]-2,3-dihydro-, (2S)-
                
                
            
                
                Betanin (Red Beet extract diluted with Dextrin)
                
                
                
                
    
Biological Activity
[Description]:
[Related Catalog]:
[Target]
IC50: 19.2 μM (ONOO-)[1].
[In Vitro]
[In Vivo]
[Animal admin]
[References]
[Related Small Molecules]
Chemical & Physical Properties
[ Density]:
1.8±0.1 g/cm3
            
[ Boiling Point ]:
983.5±75.0 °C at 760 mmHg
            
[ Molecular Formula ]:
C24H26N2O13
            
[ Molecular Weight ]:
550.469
            
[ Flash Point ]:
548.6±37.1 °C
            
[ Exact Mass ]:
550.143494
            
[ PSA ]:
249.38000
            
[ LogP ]:
-4.49
            
[ Vapour Pressure ]:
0.0±0.3 mmHg at 25°C
            
[ Index of Refraction ]:
1.740
            
MSDS
Toxicological Information
CHEMICAL IDENTIFICATION
- RTECS NUMBER :
- US7968100
- CHEMICAL NAME :
- 2,6-Pyridinedicarboxylic acid, 4-(2-(2-carboxy-5-(beta-D-glucopyranosyloxy)-2,3-dihy dro-6- hydroxy-1H-indol-1-yl)ethenyl)-2,3-dihydro-, (S-(R*,R*))-
- CAS REGISTRY NUMBER :
- 7659-95-2
- LAST UPDATED :
- 199112
- DATA ITEMS CITED :
- 3
- MOLECULAR FORMULA :
- C24-H26-N2-O13
- MOLECULAR WEIGHT :
- 550.52
HEALTH HAZARD DATA
ACUTE TOXICITY DATA
MUTATION DATA
- TYPE OF TEST :
- Sister chromatid exchange
- TEST SYSTEM :
- Human Lymphocyte
- DOSE/DURATION :
- 17200 gm/L
- REFERENCE :
- CYTOAN Cytologia. (Japan Pub. Trading Co. (USA), 1255 Howard St., San Francisco, CA 94103) V.1- 1929- Volume(issue)/page/year: 55,203,1990
Safety Information
[ Safety Phrases ]:
 S24/25
            
[ RIDADR ]: 
2261.0
            
[ RTECS ]: 
US7968100
            
[ Hazard Class ]:
6.1
            
[ HS Code ]:
 3203001990
            
Customs
[ HS Code ]: 3203001990