73114 DSViewer 3D 0 58 59 0 0 0 0 0 0 0 0999 V2000 2.6228 2.4092 -0.9282 O 0 0 0 0 0 0 0 0 0 1 2.7752 -3.6982 1.5240 O 0 0 0 0 0 0 0 0 0 2 5.3188 0.9265 0.2344 C 0 0 1 0 0 0 0 0 0 3 5.2100 2.4194 0.0275 C 0 0 3 0 0 0 0 0 0 4 3.9128 0.2799 -0.3079 C 0 0 2 0 0 0 0 0 0 5 6.5346 3.2837 0.2170 C 0 0 0 0 0 0 0 0 0 6 2.6000 1.2960 -0.0105 C 0 0 1 0 0 0 0 0 0 7 6.4672 0.3395 -0.6205 C 0 0 0 0 0 0 0 0 0 8 4.0532 2.9058 1.1177 C 0 0 0 0 0 0 0 0 0 9 2.7148 1.9575 1.2870 C 0 0 0 0 0 0 0 0 0 10 7.5807 2.6506 -0.7385 C 0 0 0 0 0 0 0 0 0 11 7.7910 1.1329 -0.3295 C 0 0 0 0 0 0 0 0 0 12 5.5946 0.5627 1.7568 C 0 0 0 0 0 0 0 0 0 13 3.9665 -1.2112 0.2663 C 0 0 0 0 0 0 0 0 0 14 7.1540 3.3501 1.6441 C 0 0 0 0 0 0 0 0 0 15 6.2291 4.7387 -0.1912 C 0 0 0 0 0 0 0 0 0 16 1.2107 0.6661 -0.2543 C 0 0 0 0 0 0 0 0 0 17 2.8538 -2.1176 -0.3486 C 0 0 0 0 0 0 0 0 0 18 2.9178 -3.5868 0.1018 C 0 0 1 0 0 0 0 0 0 19 4.2740 -4.1660 -0.3363 C 0 0 0 0 0 0 0 0 0 20 1.8159 -4.3307 -0.6258 C 0 0 0 0 0 0 0 0 0 21 0.9493 -5.1066 0.0226 C 0 0 0 0 0 0 0 0 0 22 4.9075 2.5435 -1.0182 H 0 0 0 0 0 0 0 0 0 23 3.8855 0.2227 -1.3995 H 0 0 0 0 0 0 0 0 0 24 6.6094 -0.7109 -0.3665 H 0 0 0 0 0 0 0 0 0 25 6.2154 0.4273 -1.6774 H 0 0 0 0 0 0 0 0 0 26 4.5326 2.9699 2.0945 H 0 0 0 0 0 0 0 0 0 27 3.7144 3.8960 0.8131 H 0 0 0 0 0 0 0 0 0 28 1.8325 2.5627 1.4953 H 0 0 0 0 0 0 0 0 0 29 2.8526 1.2283 2.0853 H 0 0 0 0 0 0 0 0 0 30 7.2203 2.7069 -1.7656 H 0 0 0 0 0 0 0 0 0 31 8.5258 3.1872 -0.6546 H 0 0 0 0 0 0 0 0 0 32 8.0293 1.0699 0.7323 H 0 0 0 0 0 0 0 0 0 33 8.6082 0.7071 -0.9117 H 0 0 0 0 0 0 0 0 0 34 5.6664 -0.5195 1.8651 H 0 0 0 0 0 0 0 0 0 35 4.7771 0.9356 2.3739 H 0 0 0 0 0 0 0 0 0 36 6.5298 1.0222 2.0770 H 0 0 0 0 0 0 0 0 0 37 4.9399 -1.6426 0.0331 H 0 0 0 0 0 0 0 0 0 38 3.8336 -1.1763 1.3476 H 0 0 0 0 0 0 0 0 0 39 8.0491 3.9716 1.6236 H 0 0 0 0 0 0 0 0 0 40 7.4177 2.3450 1.9733 H 0 0 0 0 0 0 0 0 0 41 6.4294 3.7801 2.3356 H 0 0 0 0 0 0 0 0 0 42 7.1252 5.3469 -0.0681 H 0 0 0 0 0 0 0 0 0 43 5.4329 5.1340 0.4396 H 0 0 0 0 0 0 0 0 0 44 5.9130 4.7652 -1.2340 H 0 0 0 0 0 0 0 0 0 45 1.0836 -0.1982 0.3975 H 0 0 0 0 0 0 0 0 0 46 1.1318 0.3506 -1.2947 H 0 0 0 0 0 0 0 0 0 47 0.4351 1.4008 -0.0380 H 0 0 0 0 0 0 0 0 0 48 1.8842 -1.7130 -0.0584 H 0 0 0 0 0 0 0 0 0 49 2.9502 -2.0884 -1.4340 H 0 0 0 0 0 0 0 0 0 50 1.8536 3.0058 -0.7446 H 0 0 0 0 0 0 0 0 0 51 4.3750 -4.0778 -1.4179 H 0 0 0 0 0 0 0 0 0 52 4.3302 -5.2166 -0.0511 H 0 0 0 0 0 0 0 0 0 53 5.0791 -3.6146 0.1495 H 0 0 0 0 0 0 0 0 0 54 1.7306 -4.2281 -1.7076 H 0 0 0 0 0 0 0 0 0 55 2.8391 -4.6503 1.7957 H 0 0 0 0 0 0 0 0 0 56 1.0219 -5.2191 1.1043 H 0 0 0 0 0 0 0 0 0 57 0.1674 -5.6291 -0.5284 H 0 0 0 0 0 0 0 0 0 58 7 1 1 0 0 0 1 51 1 0 0 0 19 2 1 0 0 0 2 56 1 0 0 0 3 4 1 0 0 0 3 5 1 0 0 0 3 8 1 0 0 0 3 13 1 0 0 0 4 6 1 0 0 0 4 9 1 0 0 0 4 23 1 0 0 0 5 7 1 0 0 0 5 14 1 0 0 0 5 24 1 0 0 0 6 11 1 0 0 0 6 15 1 0 0 0 6 16 1 0 0 0 7 10 1 0 0 0 7 17 1 0 0 0 8 12 1 0 0 0 8 25 1 0 0 0 8 26 1 0 0 0 9 10 1 0 0 0 9 27 1 0 0 0 9 28 1 0 0 0 10 29 1 0 0 0 10 30 1 0 0 0 11 12 1 0 0 0 11 31 1 0 0 0 11 32 1 0 0 0 12 33 1 0 0 0 12 34 1 0 0 0 13 35 1 0 0 0 13 36 1 0 0 0 13 37 1 0 0 0 14 18 1 0 0 0 14 38 1 0 0 0 14 39 1 0 0 0 15 40 1 0 0 0 15 41 1 0 0 0 15 42 1 0 0 0 16 43 1 0 0 0 16 44 1 0 0 0 16 45 1 0 0 0 17 46 1 0 0 0 17 47 1 0 0 0 17 48 1 0 0 0 18 19 1 0 0 0 18 49 1 0 0 0 18 50 1 0 0 0 19 20 1 0 0 0 19 21 1 0 0 0 20 52 1 0 0 0 20 53 1 0 0 0 20 54 1 0 0 0 21 22 2 0 0 0 21 55 1 0 0 0 22 57 1 0 0 0 22 58 1 0 0 0 M END > 73114 > 1 > 429 > 2 > 2 > 4 > AAADcfB4MAAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAADAAAAAGgAACAAAD0SAgAACAAAAAgCAACBCAAAAAAAgAAAIAAAAAAgABAIAAAAAQAAEgAAAEAGA4PQPgAAAAAAAAADAAAYAADAAAAAAAAAAAA== > (1R,2R,8aS)-1-[(3R)-3-hydroxy-3-methyl-pent-4-enyl]-2,5,5,8a-tetramethyl-decalin-2-ol > (1R,2R,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol > (1R,2R,8aS)-1-[(3R)-3-hydroxy-3-methylpent-4-enyl]-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol > (1R,2R,8aS)-2,5,5,8a-tetramethyl-1-[(3R)-3-methyl-3-oxidanyl-pent-4-enyl]-3,4,4a,6,7,8-hexahydro-1H-naphthalen-2-ol > (1R,2R,8aS)-1-[(3R)-3-hydroxy-3-methyl-pent-4-enyl]-2,5,5,8a-tetramethyl-decalin-2-ol > InChI=1S/C20H36O2/c1-7-18(4,21)13-9-16-19(5)12-8-11-17(2,3)15(19)10-14-20(16,6)22/h7,15-16,21-22H,1,8-14H2,2-6H3/t15?,16-,18+,19+,20-/m1/s1 > XVULBTBTFGYVRC-FFADBYAMSA-N > 4.9 > 308.272 > C20H36O2 > 308.499 > CC1(CCCC2(C1CCC(C2CCC(C)(C=C)O)(C)O)C)C > C[C@]12CCCC(C1CC[C@@]([C@@H]2CC[C@](C)(C=C)O)(C)O)(C)C > 40.5 > 308.272 > 0 > 22 > 4 > 1 > 0 > 0 > 0 > 1 > 1 > 1 5 255 > 7 1 6 19 2 5 3 13 5 4 6 3 5 14 5 $$$$