2-azaniumyl-7-(methylsulfanyl)heptanoate CDK 2/12/10,15:28 12 11 0 0 0 0 0 0 0 0999 V2000 1.1908 1.0542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1908 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9053 -0.1833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4763 -0.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4763 -1.0083 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2382 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9526 -0.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6671 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3816 -0.1833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0961 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8106 -0.1833 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.5251 0.2292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 2 0 0 0 0 3 2 1 0 0 0 0 4 2 1 0 0 0 0 4 5 1 0 0 0 0 6 4 1 0 0 0 0 7 6 1 0 0 0 0 8 7 1 0 0 0 0 9 8 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 M CHG 1 3 -1 M CHG 1 5 1 M END > CHEBI:58833 > trihomomethionine zwitterion > Zwitterionic form of trihomomethionine. > 3 > 2-ammonio-7-(methylsulfanyl)heptanoate > 2-azaniumyl-7-(methylsulfanyl)heptanoate > C8H17NO2S > 191.29100 > 191.09800 > 0 > CSCCCCCC([NH3+])C([O-])=O > InChI=1S/C8H17NO2S/c1-12-6-4-2-3-5-7(9)8(10)11/h7H,2-6,9H2,1H3,(H,10,11) > UKDJCWUSWYBRDM-UHFFFAOYSA-N $$$$