*** CHEMICAL IDENTIFICATION *** RTECS NUMBER : YF6825000 CHEMICAL NAME : Trigonelline CAS REGISTRY NUMBER : 535-83-1 BEILSTEIN REFERENCE NO. : 3905114 REFERENCE : 5-22-02-00143 (Beilstein Handbook Reference) LAST UPDATED : 199712 DATA ITEMS CITED : 3 MOLECULAR FORMULA : C7-H7-N-O2 MOLECULAR WEIGHT : 137.15 WISWESSER LINE NOTATION : T6KJ A1 CVQ &Q COMPOUND DESCRIPTOR : Mutagen Natural Product SYNONYMS/TRADE NAMES : * Betain nicotinate * Betaine nicotinate * Caffearine * 3-Carboxy-1-methylpyridinium hydroxide inner salt * Coffearin * Coffearine * Gynesine * N-Methylnicotinate * N-Methylnicotinic acid * N'-Methylnicotinic acid * Nicotinic acid N-methylbetaine * Pyridinium, 3-carboxy-1-methyl-, hydroxide, inner salt * Trigenolline * Trigonellin *** HEALTH HAZARD DATA *** ** ACUTE TOXICITY DATA ** TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Oral SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 5 gm/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : AIPTAK Archives Internationales de Pharmacodynamie et de Therapie. (Heymans Institute of Pharmacology, De Pintelaan 185, B-9000 Ghent, Belgium) V.4- 1898- Volume(issue)/page/year: 210,27,1974 TYPE OF TEST : LD50 - Lethal dose, 50 percent kill ROUTE OF EXPOSURE : Subcutaneous SPECIES OBSERVED : Rodent - rat DOSE/DURATION : 5 gm/kg TOXIC EFFECTS : Details of toxic effects not reported other than lethal dose value REFERENCE : PSEBAA Proceedings of the Society for Experimental Biology and Medicine. (Academic Press, Inc., 1 E. First St., Duluth, MN 55802) V.1- 1903/04- Volume(issue)/page/year: 62,19,1946 ** MUTATION DATA ** TYPE OF TEST : Mutation in microorganisms TEST SYSTEM : Bacteria - Salmonella typhimurium DOSE/DURATION : 1 mmol/plate REFERENCE : MUREAV Mutation Research. (Elsevier Science Pub. B.V., POB 211, 1000 AE Amsterdam, Netherlands) V.1- 1964- Volume(issue)/page/year: 391,171,1997 *** END OF RECORD ***