24 27 0 0001 0 0 0 0 0999 V2000 2.0000 -1.3828 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.1803 -1.0567 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.6285 0.6163 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 11.0780 -1.8331 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 4.2547 1.5660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 2.5004 -0.5165 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.0004 -1.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.9913 0.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.7325 -0.3825 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.8560 0.1357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.4372 -1.4272 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.2143 -0.7979 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.7547 2.4320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.8874 -0.3496 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.8533 -0.6084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.1121 -1.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.5604 0.0987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.3016 1.0646 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.1601 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.0087 1.7717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 12.2334 0.5470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.9746 1.5129 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.1984 1.3561 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 4.5254 -1.1553 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 6 1 1 6 7 1 1 6 2 12 1 0 2 14 1 0 3 14 2 0 4 16 1 0 5 8 1 0 5 9 1 0 5 13 1 0 6 7 1 0 6 8 1 0 7 9 1 0 8 10 1 0 8 23 1 1 9 11 1 0 9 24 1 6 10 12 1 0 11 12 1 0 14 15 1 0 15 16 1 6 15 17 1 0 17 18 2 0 17 19 1 0 18 20 1 0 19 21 2 0 20 22 2 0 21 22 1 0 M END > 6 1 6 7 1 6 15 16 6 17 18 8 17 19 8 18 20 8 19 21 8 20 22 8 21 22 8 8 25 5 9 26 6 > InChI=1S/C17H21NO4/c1-18-13-7-11(8-14(18)16-15(13)22-16)21-17(20)12(9-19)10-5-3-2-4-6-10/h2-6,11-16,19H,7-9H2,1H3/t11?,12-,13-,14+,15-,16+/m0/s1 > STECJAGHUSJQJN-GAUPFVANSA-N > 1/0/N:13,22,20,21,18,19,11,10,16,17,12,15,9,8,7,6,14,5,4,3,2,1/E:(3,4)(5,6)(7,8)(13,14)(15,16)/it:11?,12+,13-,14+,15-,16+/iN:13,22,20,21,18,19,10,11,16,17,12,15,8,9,6,7,14,5,4,3,2,1/rA:43cOOOONCCCCCCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHHHH/rB:;;;;n1;n1s6;s5s6;s5s7;s8;s9;s2s10s11;s5;s2d3;s14;s4N15;s15;d17;s17;s18;d19;d20s21;s6;s7;P8;N9;s10;s10;s11;s11;s12;s13;s13;s13;s15;s16;s16;s18;s19;s4;s20;s21;s22;/rC:2,-1.3828,0;8.1803,-1.0567,0;8.6285,.6163,0;11.078,-1.8331,0;4.2547,1.566,0;2.5004,-.5165,0;3.0004,-1.3825,0;4.9913,.5834,0;4.7325,-.3825,0;6.856,.1357,0;6.4372,-1.4272,0;7.2143,-.7979,0;3.7547,2.432,0;8.8874,-.3496,0;9.8533,-.6084,0;10.1121,-1.5743,0;10.5604,.0987,0;10.3016,1.0646,0;11.5263,-.1601,0;11.0087,1.7717,0;12.2334,.547,0;11.9746,1.5129,0;2.1904,.0204,0;3.3104,-1.9195,0;5.1984,1.3561,0;4.5254,-1.1553,0;7.4675,.238,0;6.8776,.7553,0;6.0555,-1.9158,0;6.8794,-1.8618,0;7.3432,-1.4043,0;4.2916,2.742,0;3.2178,2.122,0;3.4447,2.969,0;10.4522,-.7689,0;10.0581,-2.192,0;9.4945,-1.6284,0;9.7027,1.2251,0;11.6868,-.759,0;11.2385,-2.432,0;10.8482,2.3706,0;12.8323,.3865,0;12.413,1.9513,0; > C17 H21 N O4 > 303.3529 > O1[C@@]2([H])[C@]3([H])C([H])([H])C([H])(C([H])([H])[C@]([H])([C@@]12[H])N3C([H])([H])[H])OC([C@]([H])(C1C([H])=C([H])C([H])=C([H])C=1[H])C([H])([H])O[H])=O > 553881 $$$$