11334208 CDK 0510212310 18 18 0 0 0 0 0 0 0 0999 V2000 4.5080 2.1120 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2329 -0.1359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -0.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4464 -0.9328 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4360 0.0776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 0.0495 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0339 -1.6473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -0.3630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2224 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 0.8745 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2089 -1.6473 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -1.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 1.2870 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5080 -1.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3645 -1.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7935 -1.6005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0790 -1.1880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 4 8 1 0 0 0 0 5 9 1 0 0 0 0 6 10 1 0 0 0 0 7 11 1 0 0 0 0 8 12 1 0 0 0 0 9 13 1 0 0 0 0 10 14 1 0 0 0 0 11 14 1 0 0 0 0 12 15 1 0 0 0 0 13 16 1 0 0 0 0 15 17 1 0 0 0 0 16 18 1 0 0 0 0 17 18 2 0 0 0 0 M END > CHEBI:172492 > (Z)-9-Cycloheptadecen-1-one > 2 > (9E)-cycloheptadec-9-en-1-one > C17H30O > 250.426 > 250.22967 > 0 > O=C1CCCCCCCC=CCCCCCCC1 > InChI=1S/C17H30O/c18-17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-17/h1-2H,3-16H2/b2-1+ > ZKVZSBSZTMPBQR-OWOJBTEDSA-N $$$$