Mrv1533004171507112D 30 33 0 0 0 0 999 V2000 4.4348 -3.5149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4718 -2.6907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2041 -2.3107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7766 -2.2466 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8136 -1.4224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1184 -0.9782 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8017 -1.7400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6765 -0.3707 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4294 0.4164 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6242 0.5960 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0661 -0.0115 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8257 0.7777 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3132 -0.7987 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7596 -1.4229 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9506 -1.2543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4165 -1.8832 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6469 -0.4671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1726 0.0666 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4028 0.5335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1586 1.1914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0038 1.0309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5595 1.6408 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3092 2.4269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5032 2.6032 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8648 3.0367 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2474 0.1857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7854 -0.2403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5987 -0.3788 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1637 -0.8483 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3012 -1.6618 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 6 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 15 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 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 21 26 1 0 0 0 0 11 26 1 0 0 0 0 17 26 1 0 0 0 0 19 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 17 29 1 0 0 0 0 29 30 2 0 0 0 0 M END > NP0284330 > NP-MRD > CC(=O)OCC1(C)CCCC2(C)C1CC(O)C13CC(CC(OC(C)=O)C21)C(=C)C3=O > InChI=1S/C24H34O6/c1-13-16-9-17(30-15(3)26)20-23(5)8-6-7-22(4,12-29-14(2)25)18(23)10-19(27)24(20,11-16)21(13)28/h16-20,27H,1,6-12H2,2-5H3 > QNEZSDDLINHAAS-UHFFFAOYSA-N > C24H34O6 > 418.53 > 418.235538815 > 4 > 64 > 45.22757010107308 > 1 > 1 > 0 > 1 > [11-(acetyloxy)-2-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-5-yl]methyl acetate > 2.02 > 2.5226929680000003 > -4.52 > 0 > 4 > 0 > 14.497597479311256 > -3.0185508625492563 > 89.9 > 109.57709999999997 > 5 > 1 > 1.27e-02 g/l > [11-(acetyloxy)-2-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-5-yl]methyl acetate > 0 > NP0284330 > [11-(acetyloxy)-2-hydroxy-5,9-dimethyl-14-methylidene-15-oxotetracyclo[11.2.1.0¹,¹⁰.0⁴,⁹]hexadecan-5-yl]methyl acetate $$$$