Mrv1652309072214252D 23 23 0 0 1 0 999 V2000 0.4052 -3.8186 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1585 -3.0314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7169 -2.4241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4702 -1.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0286 -1.0296 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7819 -0.2423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 0.0208 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6724 -0.4571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0087 0.8458 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7959 1.0925 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2738 0.4200 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9968 0.8175 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9883 0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7028 0.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4172 0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1317 0.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8462 0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5607 0.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2751 0.0075 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9896 0.4200 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9896 1.2450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7041 0.0075 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4185 0.4200 0.0000 C 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 5 6 2 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 10 11 1 0 0 0 0 6 11 1 0 0 0 0 11 12 1 6 0 0 0 11 13 1 1 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 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 M END > NP0249773 > NP-MRD > CC\C=C\C=C1/C(=O)C=C[C@@]1(O)CCCCCCCC(=O)OC > InChI=1S/C19H28O4/c1-3-4-8-11-16-17(20)13-15-19(16,22)14-10-7-5-6-9-12-18(21)23-2/h4,8,11,13,15,22H,3,5-7,9-10,12,14H2,1-2H3/b8-4+,16-11+/t19-/m0/s1 > CSKWXYDNGLJFQE-HFRWRIIYSA-N > C19H28O4 > 320.429 > 320.198759382 > 3 > 51 > 37.420642311302416 > 1 > 1 > 0 > 1 > methyl 8-[(1S,5Z)-1-hydroxy-4-oxo-5-[(2E)-pent-2-en-1-ylidene]cyclopent-2-en-1-yl]octanoate > 4.072435809 > 0 > 1 > 0 > 13.558569668509968 > -3.429281626993739 > 63.599999999999994 > 94.2749 > 11 > 1 > methyl 8-[(1S,5Z)-1-hydroxy-4-oxo-5-[(2E)-pent-2-en-1-ylidene]cyclopent-2-en-1-yl]octanoate > 0 > NP0249773 > methyl 8-[(1s,5z)-1-hydroxy-4-oxo-5-[(2e)-pent-2-en-1-ylidene]cyclopent-2-en-1-yl]octanoate $$$$