52948928 -OEChem-09272320532D 56 57 0 1 0 0 0 0 0999 V2000 9.2509 2.9987 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.9192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.5808 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.8671 1.5808 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7610 2.1154 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.0010 0.0808 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.7610 0.0461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 1.6016 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6671 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.4192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2510 2.9872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2510 2.9756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.0808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -2.4192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.9192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.4192 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8605 2.4308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3564 -0.4237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1546 -0.4329 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 2.5557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 2.5557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2779 1.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8761 2.1853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8761 -0.0237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2779 0.6660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2471 -0.4192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.0392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4871 -0.4192 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 2.1634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5244 1.4731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3516 3.5990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6659 3.1925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2131 -1.5018 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6116 -0.8116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7843 3.2918 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9348 3.5089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7177 2.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9230 -0.8366 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5244 -1.5269 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.3908 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5547 3.5392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6910 -3.4562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5380 -3.2292 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3110 -2.3823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.5392 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -1.9443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0044 -1.9443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.6092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 49 1 0 0 0 0 2 22 1 0 0 0 0 2 56 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 3 7 1 0 0 0 0 3 11 1 1 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 23 1 6 0 0 0 5 9 1 0 0 0 0 5 14 1 0 0 0 0 5 16 1 1 0 0 0 6 13 1 0 0 0 0 6 15 1 1 0 0 0 6 24 1 0 0 0 0 7 10 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 12 1 0 0 0 0 8 27 1 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 18 2 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 17 1 0 0 0 0 15 40 1 0 0 0 0 15 41 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 19 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 M END > 52948928 > 1 > 439 > 2 > 2 > 5 > AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAADAAAAAGgAACAAADwCggAICAAAAAgCAAiBCAAAAAAAgAAAACAAAAAgAFAIAAQAAUAAEgAAIEAOAwPAPgAAAAAAAAAAAAAQAACAAAAAAAAAAAA== > (Z)-5-[(1S,4aR,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-decalin-1-yl]-3-methyl-pent-2-en-1-ol > (Z)-5-[(1S,4aR,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-2-penten-1-ol > (Z)-5-[(1S,4aR,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-en-1-ol > (Z)-5-[(1S,4aR,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-en-1-ol > (Z)-5-[(1S,4aR,5R,8aR)-5-(hydroxymethyl)-5,8a-dimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methyl-pent-2-en-1-ol > (Z)-5-[(1S,4aR,5R,8aR)-5,8a-dimethyl-2-methylene-5-methylol-decalin-1-yl]-3-methyl-pent-2-en-1-ol > InChI=1S/C20H34O2/c1-15(10-13-21)6-8-17-16(2)7-9-18-19(3,14-22)11-5-12-20(17,18)4/h10,17-18,21-22H,2,5-9,11-14H2,1,3-4H3/b15-10-/t17-,18-,19-,20+/m0/s1 > MJHWZTRFACWHTA-COPBVACWSA-N > 4.7 > 306.255880323 > C20H34O2 > 306.5 > CC(=CCO)CCC1C(=C)CCC2C1(CCCC2(C)CO)C > C/C(=C/CO)/CC[C@H]1C(=C)CC[C@@H]2[C@@]1(CCC[C@@]2(C)CO)C > 40.5 > 306.255880323 > 0 > 22 > 4 > 0 > 1 > 0 > 0 > 1 > -1 > 1 5 255 > 3 11 5 4 23 6 5 16 5 6 15 5 $$$$