Mrv1652309092203262D 20 20 0 0 1 0 999 V2000 2.5788 4.4844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3807 3.6836 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 3.4548 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3899 2.6539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9843 2.0819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 1.2810 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.3807 0.7090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1733 0.9378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7678 0.3658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5696 -0.4351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 -0.6639 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5788 -1.4647 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7862 -1.6935 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1917 -1.1215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3991 -1.3503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1954 -0.7783 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0028 0.0226 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7954 0.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3899 -0.3207 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9935 1.0522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 4 5 1 0 0 0 0 6 5 1 1 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 6 20 1 0 0 0 0 M END > NP0277015 > NP-MRD > CC\C=C/C[C@@H]1OC(=O)CCCCCCC\C=C/C=C/1 > InChI=1S/C18H28O2/c1-2-3-11-14-17-15-12-9-7-5-4-6-8-10-13-16-18(19)20-17/h3,7,9,11-12,15,17H,2,4-6,8,10,13-14,16H2,1H3/b9-7-,11-3-,15-12+/t17-/m0/s1 > AEOCGZGNXNIVTO-FQSPHKRJSA-N > C18H28O2 > 276.42 > 276.208930142 > 1 > 48 > 33.282229366162895 > 1 > 0 > 0 > 1 > (10Z,12E,14S)-14-[(2Z)-pent-2-en-1-yl]-1-oxacyclotetradeca-10,12-dien-2-one > 5.493615195333334 > 0 > 1 > 0 > -7.052897596682207 > 26.3 > 87.6587 > 3 > 0 > (10Z,12E,14S)-14-[(2Z)-pent-2-en-1-yl]-1-oxacyclotetradeca-10,12-dien-2-one > 1 > NP0277015 > (10z,12e,14s)-14-[(2z)-pent-2-en-1-yl]-1-oxacyclotetradeca-10,12-dien-2-one $$$$