Mrv1652309102211172D 36 40 0 0 1 0 999 V2000 0.6979 -0.5106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7355 -1.3348 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0406 -1.7794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4680 -1.7143 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -1.2696 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1254 -0.4455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8203 -0.0009 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5152 0.4438 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5528 -0.3804 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3770 -0.3428 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5904 -1.2045 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3229 -1.5840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0179 -1.1394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1524 -0.3254 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5730 0.2619 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9681 -0.2019 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3476 0.5307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3377 -0.9395 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7504 -1.5189 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7880 -2.3430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0931 -2.7877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1307 -3.6118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3606 -2.4082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6656 -2.8528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9331 -2.4733 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.2382 -2.9179 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2758 -3.7421 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5808 -4.1867 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0083 -4.1216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7032 -3.6769 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4358 -4.0564 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4734 -4.8806 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7784 -5.3252 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0459 -4.9457 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8955 -1.6491 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.2006 -2.0938 0.0000 C 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 5 4 1 1 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 6 0 0 0 8 9 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 1 0 0 0 9 11 1 0 0 0 0 11 12 1 6 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 18 1 1 0 0 0 13 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 4 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 6 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 2 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 29 34 1 0 0 0 0 25 35 1 0 0 0 0 5 35 1 0 0 0 0 11 35 1 0 0 0 0 35 36 1 6 0 0 0 M END > NP0298220 > NP-MRD > CC(=O)O[C@H]1C[C@@H]2O[C@]2(C)[C@@H]2CC3=C(C)C(=O)O[C@H]3C=C(C)CC[C@H](OC(=O)C3=CC=CC=C3)[C@@]12C > InChI=1S/C29H34O7/c1-16-11-12-23(35-27(32)19-9-7-6-8-10-19)28(4)22(14-20-17(2)26(31)34-21(20)13-16)29(5)25(36-29)15-24(28)33-18(3)30/h6-10,13,21-25H,11-12,14-15H2,1-5H3/t21-,22+,23-,24-,25-,28-,29+/m0/s1 > GAGKMCOQPVBDOW-FADHDPPFSA-N > C29H34O7 > 494.584 > 494.230453435 > 4 > 70 > 52.11898585424524 > 1 > 0 > 0 > 0 > (1R,7S,12S,13S,14S,16S,18R)-14-(acetyloxy)-4,9,13,18-tetramethyl-5-oxo-6,17-dioxatetracyclo[11.5.0.0^{3,7}.0^{16,18}]octadeca-3,8-dien-12-yl benzoate > 4.671206962333333 > 0 > 5 > 0 > 13.686421621168506 > -4.2247824439133534 > 91.43 > 132.29180000000002 > 5 > 1 > (1R,7S,12S,13S,14S,16S,18R)-14-(acetyloxy)-4,9,13,18-tetramethyl-5-oxo-6,17-dioxatetracyclo[11.5.0.0^{3,7}.0^{16,18}]octadeca-3,8-dien-12-yl benzoate > 0 > NP0298220 > (1r,7s,12s,13s,14s,16s,18r)-14-(acetyloxy)-4,9,13,18-tetramethyl-5-oxo-6,17-dioxatetracyclo[11.5.0.0³,⁷.0¹⁶,¹⁸]octadeca-3,8-dien-12-yl benzoate $$$$