13 14 0 0001 0 0 0 0 0999 V2000 0.0000 -2.3107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 5.5525 -4.2196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 6.6978 -2.2371 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 4.4004 -3.5632 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 3.1346 -1.8218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.1346 -0.4889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.9758 -1.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.4004 -2.2304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.4004 -0.0737 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.1841 -1.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0.6698 -1.1520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.5525 -2.9001 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1 12 2 0 2 12 1 0 3 13 2 0 4 13 1 0 9 5 1 6 6 7 1 0 6 8 1 0 6 9 1 6 7 8 1 0 7 10 1 6 8 12 1 1 9 11 1 0 9 13 1 0 10 11 1 0 M END > InChI=1S/C8H11NO4/c9-8(7(12)13)2-1-3-4(5(3)8)6(10)11/h3-5H,1-2,9H2,(H,10,11)(H,12,13)/t3-,4-,5-,8-/m0/s1 > VTAARTQTOOYTES-RGDLXGNYSA-N > 1/1/N:10,11,7,8,6,12,13,9,5,1,2,3,4/E:(10,11)(12,13)/it:im/rA:13cOOOONCCCCCCCC/rB:;;;;;s6;s6s7;n5N6;N7;s9s10;d1s2P8;d3s4s9;/rC:0,-2.3107,0;;5.5525,-4.2196,0;6.6978,-2.2371,0;4.4004,-3.5632,0;3.1346,-1.8218,0;3.1346,-.4889,0;1.9758,-1.152,0;4.4004,-2.2304,0;4.4004,-.0737,0;5.1841,-1.152,0;.6698,-1.152,0;5.5525,-2.9001,0; > C8 H11 N O4 > 185.1772 > O=C([C@H]1[C@@H]2CC[C@@](C(O)=O)([C@@H]21)N)O > 184747 $$$$