11876195 CDK 1019211303 19 20 0 0 0 0 0 0 0 0999 V2000 6.8071 -1.3665 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0929 -0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 0.6188 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6654 0.6188 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6654 -0.2063 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4028 -0.6474 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9508 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9508 1.0313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4028 1.0599 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2364 -0.2063 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.1504 -0.2234 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2364 0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1504 0.6359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6654 1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9821 -1.3570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 -0.6188 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8075 -0.2063 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5219 -1.4438 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6599 -0.9075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6 1 1 1 0 0 0 2 17 1 0 0 0 0 3 17 2 0 0 0 0 4 5 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 14 1 6 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 1 0 0 0 6 11 1 0 0 0 0 6 15 1 0 0 0 0 7 10 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 6 0 0 0 11 13 1 0 0 0 0 16 17 1 0 0 0 0 16 18 2 0 0 0 0 M END > CHEBI:181639 > Ilicic acid > 2 > 2-[(2R,4aR,8R,8aR)-8-hydroxy-4a,8-dimethyl-1,2,3,4,5,6,7,8a-octahydronaphthalen-2-yl]prop-2-enoic acid > C15H24O3 > 252.354 > 252.17254 > 0 > O[C@]1([C@]2([C@@](CC[C@H](C2)C(C(O)=O)=C)(CCC1)C)[H])C > InChI=1S/C15H24O3/c1-10(13(16)17)11-5-8-14(2)6-4-7-15(3,18)12(14)9-11/h11-12,18H,1,4-9H2,2-3H3,(H,16,17)/t11-,12-,14-,15-/m1/s1 > FXKCXGBBUBCRPU-QHSBEEBCSA-N $$$$