Mrv1652304282211402D 27 29 0 0 1 0 999 V2000 -0.3042 -0.0967 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2314 -0.7243 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0426 -0.5743 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3183 0.2033 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.7828 0.8309 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.0285 0.6808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0585 1.6084 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.8697 1.7584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4053 1.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1296 0.3533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1454 2.5360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0281 2.2050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8302 2.0121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4845 1.5096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8779 0.7844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9423 -0.0380 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6666 -0.8156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0984 -1.4138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5655 -2.0939 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3361 -1.7292 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5114 -1.7073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3185 -2.5094 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7669 -1.3518 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1121 2.0452 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2472 1.4584 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2209 -1.3798 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8101 -0.8769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2 1 1 1 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 1 6 1 0 0 0 0 5 7 1 0 0 0 0 7 8 1 1 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 4 10 1 6 0 0 0 8 11 1 0 0 0 0 7 12 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 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 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 2 23 1 0 0 0 0 14 24 1 0 0 0 0 5 25 1 1 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 M END > NP0065458 > NP-MRD > CC1=CC[C@@H]2C(C)(C)[C@@H]3CC[C@]2(C)[C@@H]1CC\C(C)=C/COC(=O)CC(=O)O3 > InChI=1S/C23H34O4/c1-15-6-8-17-16(2)7-9-18-22(3,4)19(10-12-23(17,18)5)27-21(25)14-20(24)26-13-11-15/h7,11,17-19H,6,8-10,12-14H2,1-5H3/b15-11-/t17-,18-,19+,23-/m1/s1 > LLMHUMBEEZSSMH-AMQPWGHFSA-N > C23H34O4 > 374.521 > 374.245709575 > 2 > 61 > 41.74086247120845 > 1 > 0 > 0 > 1 > (1S,5R,8E,16S,19R)-4,8,19,20,20-pentamethyl-11,15-dioxatricyclo[14.3.1.0^{5,19}]icosa-3,8-diene-12,14-dione > 5.54 > 4.868390689999999 > -4.82 > 0 > 3 > 0 > 11.49861891854523 > -6.857104345808612 > 52.60000000000001 > 106.64519999999997 > 0 > 1 > 5.69e-03 g/l > (1S,5R,8E,16S,19R)-4,8,19,20,20-pentamethyl-11,15-dioxatricyclo[14.3.1.0^{5,19}]icosa-3,8-diene-12,14-dione > 0 > NP0065458 > Corymbi-7,13E-dienolide $$$$