11199982 -OEChem-03282414362D 72 74 0 1 0 0 0 0 0999 V2000 2.8660 -0.1565 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.1565 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.2764 0.1482 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3301 -1.1565 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 7.8600 -0.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2764 -1.4612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.3435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5870 1.0987 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3301 0.8435 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5655 1.3050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9192 1.8430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8762 2.2555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8547 2.4617 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1653 3.4122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1439 3.6184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4975 4.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.1565 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0000 -2.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.6565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.1565 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1160 0.2801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3957 -1.7730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3208 -1.0712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3208 -0.2418 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0253 -2.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8137 -1.7705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 0.8184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 0.8184 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9803 0.9709 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9501 0.8435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.4635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7101 0.8435 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 0.4261 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -0.2642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5861 0.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1793 1.2176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -1.4665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3806 2.2571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5051 2.3045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4577 1.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8556 2.8751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2624 2.3428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8752 1.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4685 2.3743 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.7765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5587 3.2844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -1.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -1.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2717 3.0118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7505 3.7463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0160 4.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9590 4.5706 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0834 4.6180 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0360 3.7424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.8465 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -2.5488 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -3.2391 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7880 -1.0739 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3894 -1.7642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.1565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.7765 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -4.1565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 0.1535 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 25 1 1 6 0 0 0 1 72 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 7 1 0 0 0 0 2 9 1 1 0 0 0 3 5 1 0 0 0 0 3 8 1 0 0 0 0 3 29 1 6 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 11 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 12 1 0 0 0 0 8 14 1 6 0 0 0 8 37 1 0 0 0 0 9 38 1 0 0 0 0 9 39 1 0 0 0 0 9 40 1 0 0 0 0 10 13 2 0 0 0 0 10 16 1 0 0 0 0 11 13 1 0 0 0 0 11 41 1 0 0 0 0 11 42 1 0 0 0 0 12 15 1 0 0 0 0 12 43 1 0 0 0 0 12 44 1 0 0 0 0 13 45 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 17 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 18 2 0 0 0 0 16 51 1 0 0 0 0 17 19 1 0 0 0 0 17 52 1 0 0 0 0 17 53 1 0 0 0 0 18 20 1 0 0 0 0 18 54 1 0 0 0 0 19 22 1 0 0 0 0 19 23 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 24 2 0 0 0 0 21 25 1 0 0 0 0 21 56 1 0 0 0 0 21 57 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 22 60 1 0 0 0 0 23 61 1 0 0 0 0 23 62 1 0 0 0 0 23 63 1 0 0 0 0 24 26 1 0 0 0 0 24 28 1 0 0 0 0 25 27 1 0 0 0 0 25 64 1 0 0 0 0 26 27 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 27 67 1 0 0 0 0 27 68 1 0 0 0 0 28 69 1 0 0 0 0 28 70 1 0 0 0 0 28 71 1 0 0 0 0 M END > 11199982 > 1 > 622 > 1 > 1 > 7 > AAADcfB4IAAAAAAAAAAAAAAAAAAAAYAAAAAgQAAAAAAAAEAAAAAAGgAACAAADxSggAICAAAAAgCAAiBCAAAAAAAgAAAICAAAAAgIEAIAAQAAQAAEwAAIgAOAgMAPgAAAAAAAAAAAAAAAAAAAAQAACAAAAA== > (1S)-3-[(Z)-2-[(1R,7aR)-1-[(1R)-1,5-dimethylhexyl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]vinyl]-4-methyl-cyclohex-3-en-1-ol > (1S)-3-[(Z)-2-[(1R,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methyl-1-cyclohex-3-enol > (1S)-3-[(Z)-2-[(1R,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol > (1S)-3-[(Z)-2-[(1R,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methylcyclohex-3-en-1-ol > (1S)-3-[(Z)-2-[(1R,7aR)-7a-methyl-1-[(2R)-6-methylheptan-2-yl]-1,2,3,3a,6,7-hexahydroinden-4-yl]ethenyl]-4-methyl-cyclohex-3-en-1-ol > (1S)-3-[(Z)-2-[(1R,7aR)-1-[(1R)-1,5-dimethylhexyl]-7a-methyl-1,2,3,3a,6,7-hexahydroinden-4-yl]vinyl]-4-methyl-cyclohex-3-en-1-ol > InChI=1S/C27H44O/c1-19(2)8-6-9-21(4)25-15-16-26-22(10-7-17-27(25,26)5)12-13-23-18-24(28)14-11-20(23)3/h10,12-13,19,21,24-26,28H,6-9,11,14-18H2,1-5H3/b13-12-/t21-,24+,25-,26?,27-/m1/s1 > YUGCAAVRZWBXEQ-QEYGBBHESA-N > 7.7 > 384.339216023 > C27H44O > 384.6 > CC1=C(CC(CC1)O)C=CC2=CCCC3(C2CCC3C(C)CCCC(C)C)C > CC1=C(C[C@H](CC1)O)/C=C\C2=CCC[C@]3(C2CC[C@@H]3[C@H](C)CCCC(C)C)C > 20.2 > 384.339216023 > 0 > 28 > 4 > 1 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 25 1 6 2 9 5 3 29 6 4 6 3 8 14 6 $$$$