betonicine
(2S-trans)-2-carboxylato-4-hydroxy-1,1-dimethylpyrrolidinium
Identification
| Name | betonicine |
| IUPAC | (2S,4R)-4-hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylate |
| CAS Number | 515-25-3 |
| EINECS | 208-195-6 |
| FDA UNII | FBA654632Q |
| Molecular Formula | C7 H13 N O3 |
| Molecular Weight | 159.18521000 |
| MDL Number | MFCD00063554 |
Regulatory
Physical Properties
| Assay | 95.00 to 100.00 |
| Food Chemicals Codex Listed | No |
| Flash Point | 32.00 °F. TCC ( 0.00 °C. ) (est) |
| logP (o/w) | -4.240 (est) |
| Soluble in | water, 1e+006 mg/L @ 25 °C (est) |
No sensory data available
Safety Information
| Preferred SDS | View |
| Oral/Parenteral Toxicity | Not determined |
| Dermal Toxicity | Not determined |
| Inhalation Toxicity | Not determined |
GHS Classification
['GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)', 'GHS Label elements, including precautionary statements']
Safety in Use
| Category | natural substances and extractives |
| Recommendation for betonicine usage levels up to | not for fragrance use. |
| Recommendation for betonicine flavor usage levels up to | not for flavor use. |
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Potential Uses
Natural Occurrence
Synonyms
(2S-trans)-2-
carboxylato-4-hydroxy-1,1-dimethylpyrrolidinium
(2S,4R)-4-
hydroxy-1,1-dimethylpyrrolidin-1-ium-2-carboxylate
pyrrolidinium, 2-carboxy-4-hydroxy-1,1-dimethyl-, hydroxide, inner salt, (2S-trans)-
PubMed:
Plant-derived compatible solutes proline betaine and betonicine confer enhanced osmotic and temperature stress tolerance to Bacillus subtilis.
PubMed:
Betaines in fruits of Citrus genus plants.