25 28 0 0001 0 0 0 0 0999 V2000 3.4597 -1.9863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4597 -3.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3034 -2.6578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1470 -3.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 1.1470 -4.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 2.3034 -5.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 3.4597 -4.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6068 -5.3155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.7631 -4.6534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.7631 -3.3199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.9102 -2.6578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.1691 -3.0587 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.9524 -1.9863 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 8.1691 -0.9139 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 6.9102 -1.3242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 7.0500 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 5.7631 -0.6621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6068 -1.3242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6068 -2.6578 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 4.6068 -3.9820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 9.3254 -0.2518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 8.2157 -2.2474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 7.0500 -3.9820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 5.7631 -1.9863 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0.0000 -5.3155 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 2 3 1 0 2 7 1 0 2 19 1 0 3 4 1 0 4 5 1 0 5 6 1 0 5 25 2 0 6 7 2 0 7 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 10 19 1 0 10 24 1 1 11 12 1 0 11 15 1 0 11 23 1 6 12 13 1 0 13 14 1 0 14 15 1 0 14 21 1 0 14 22 1 6 15 16 1 1 15 17 1 0 17 18 1 0 18 19 1 0 19 20 1 6 M END > InChI=1S/C19H28O2/c1-18-9-7-13(20)11-12(18)3-4-14-15-5-6-17(21)19(15,2)10-8-16(14)18/h11,14-17,21H,3-10H2,1-2H3/t14-,15-,16-,17-,18-,19-/m0/s1 > MUMGGOZAMZWBJJ-DYKIIFRCSA-N > 1/0/N:1,16,8,9,12,13,4,18,3,17,6,7,5,10,11,19,14,2,15,25,21/it:im/rA:25cCCCCCCCCCCCCCCCCCCCHOHHHO/rB:p1;s2;s3;s4;s5;s2d6;s7;s8;s9;s10;s11;s12;s13;s11s14;P15;s15;s17;s2s10s18;N19;s14;N14;N11;P10;d5;/rC:3.4597,-1.9863,0;3.4597,-3.3199,0;2.3034,-2.6578,0;1.147,-3.3199,0;1.147,-4.6534,0;2.3034,-5.3155,0;3.4597,-4.6534,0;4.6068,-5.3155,0;5.7631,-4.6534,0;5.7631,-3.3199,0;6.9102,-2.6578,0;8.1691,-3.0587,0;8.9524,-1.9863,0;8.1691,-.9139,0;6.9102,-1.3242,0;7.05,0,0;5.7631,-.6621,0;4.6068,-1.3242,0;4.6068,-2.6578,0;4.6068,-3.982,0;9.3254,-.2518,0;8.2157,-2.2474,0;7.05,-3.982,0;5.7631,-1.9863,0;0,-5.3155,0; > C19 H28 O2 > 288.4244 > C[C@@]12[C@@]3([H])CC[C@]4(C)[C@@]([H])(O)CC[C@@]4([H])[C@]3([H])CCC1=CC(=O)CC2 > 5791 $$$$