25 27 0 0001 0 0 0 0 0999 V2000 9.5323 -2.1016 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 7.7839 0.9330 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 10.3984 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.5323 -0.1016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.3984 -1.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.3084 -0.0948 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.6663 -0.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.3164 0.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 9.5163 0.9399 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.4143 1.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.6663 -1.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.3984 -1.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.8984 -2.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.7724 -0.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.7724 -2.1363 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 10.4105 2.4676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.8663 -1.6224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.8663 -0.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.0022 -2.1258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.1343 -1.6291 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.2702 -2.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4022 -1.6358 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.5381 -2.1391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 11.0881 -1.0069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 10.2220 0.3037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 1 11 1 0 2 14 1 0 3 4 1 0 3 5 1 0 3 6 1 0 3 24 1 6 4 7 1 0 4 9 1 0 4 25 1 1 5 12 1 0 5 13 1 0 6 8 1 0 7 11 1 0 7 14 2 0 8 10 1 0 9 10 2 0 10 16 1 0 11 15 2 0 14 18 1 0 15 17 1 0 17 18 2 0 17 19 1 0 19 20 1 0 20 21 1 0 21 22 1 0 22 23 1 0 M END > 11 15 8 14 18 8 15 17 8 17 18 8 3 24 6 4 25 5 7 11 8 7 14 8 > InChI=1S/C21H30O2/c1-5-6-7-8-15-12-18(22)20-16-11-14(2)9-10-17(16)21(3,4)23-19(20)13-15/h11-13,16-17,22H,5-10H2,1-4H3/t16-,17-/m1/s1/i1T > CYQFCXCEBYINGO-WZCNICOGSA-N > 1/1/N:23,16,12,13,22,21,20,19,8,6,9,18,15,10,17,4,3,14,11,7,5,2,1/E:(3,4)/it:im/I:/E:m/rA:53cOOCCCCCCCCCCCCCCCCCCCCCHHHHHHHHHHHHHHHHHHHHHHHHHHHH.i3HH/rB:;;s3;s1s3;s3;s4;s6;s4;s8d9;s1s7;s5;s5;s2d7;d11;s10;s15;s14d17;s17;s19;s20;s21;s22;N3;P4;s6;s6;s8;s8;s9;s12;s12;s12;s13;s13;s13;s15;s16;s16;s16;s18;s19;s19;s20;s20;s2;s21;s21;s22;s22;s23;s23;s23;/rC:9.5323,-2.1016,0;7.7839,.933,0;10.3984,-.6016,0;9.5323,-.1016,0;10.3984,-1.6016,0;11.3084,-.0948,0;8.6663,-.6016,0;11.3164,.9468,0;9.5163,.9399,0;10.4143,1.4676,0;8.6663,-1.6016,0;11.3984,-1.6016,0;10.8984,-2.4676,0;7.7724,-.067,0;7.7724,-2.1363,0;10.4105,2.4676,0;6.8663,-1.6224,0;6.8663,-.5808,0;6.0022,-2.1258,0;5.1343,-1.6291,0;4.2702,-2.1324,0;3.4022,-1.6358,0;2.5381,-2.1391,0;11.0881,-1.0069,0;10.222,.3037,0;11.92,.0066,0;11.5129,-.6801,0;11.5299,1.5289,0;11.9264,.836,0;8.9758,1.2437,0;11.3984,-2.2216,0;12.0184,-1.6016,0;11.3984,-.9816,0;10.3614,-2.7776,0;11.2084,-3.0046,0;11.4353,-2.1576,0;7.7795,-2.7562,0;9.7905,2.4652,0;10.4081,3.0876,0;11.0304,2.47,0;6.3306,-.2687,0;5.6055,-2.6022,0;6.4026,-2.5992,0;4.7339,-1.1557,0;5.531,-1.1526,0;7.2506,1.2492,0;4.6705,-2.6058,0;3.8735,-2.6089,0;3.0019,-1.1624,0;3.7989,-1.1593,0;2,-1.8312,0;2.9385,-2.6125,0;2.1414,-2.6156,0; > C21 H30 O2 > 316.4698 > O1C2=C([H])C(C([H])([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[3H])=C([H])C(=C2[C@]2([H])C([H])=C(C([H])([H])[H])C([H])([H])C([H])([H])[C@@]2([H])C1(C([H])([H])[H])C([H])([H])[H])O[H] > 9776893 $$$$