Mrv1652309112222062D 42 43 0 0 1 0 999 V2000 4.8395 3.1746 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6262 2.2302 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8318 1.9176 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9129 1.4159 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 0.6039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3780 -0.9535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -0.1105 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.5564 0.2564 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3757 0.5966 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6741 1.4102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9585 -0.0316 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1579 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7454 -1.5395 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3322 -2.1824 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9204 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7661 -0.6778 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8305 -0.3775 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5079 -2.2539 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 -2.2539 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.4191 -3.1063 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7255 -3.9237 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5239 -4.2335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2458 -4.6238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -1.5395 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4454 -1.5395 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0329 -0.8250 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.1614 -0.8958 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6334 -1.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7192 -2.4240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2107 -1.5520 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4454 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7836 0.4384 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2704 -0.1105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 0.6039 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2593 1.4783 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4383 2.4315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0366 3.2102 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2140 2.8195 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6829 -0.8250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 -0.2698 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3964 -1.5626 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 4 5 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 1 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 2 0 0 0 0 8 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 1 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 16 19 2 0 0 0 0 19 20 1 0 0 0 0 20 21 1 6 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 2 0 0 0 0 20 25 1 0 0 0 0 25 26 1 6 0 0 0 26 27 1 0 0 0 0 27 28 1 6 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 29 31 2 0 0 0 0 27 32 1 0 0 0 0 32 33 1 0 0 0 0 32 34 2 0 0 0 0 34 35 1 0 0 0 0 5 35 1 0 0 0 0 35 36 1 1 0 0 0 36 37 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 34 40 1 0 0 0 0 25 40 1 0 0 0 0 40 41 1 0 0 0 0 40 42 1 0 0 0 0 M END > NP0319194 > NP-MRD > CC(=O)O[C@H]1C[C@H]2[C@@H](OC(C)=O)\C=C(CO)\[C@H](O)C[C@H](OC(C)=O)\C(C)=C(OC(C)=O)\[C@H](OC(C)=O)C(=C1C)C2(C)C > InChI=1S/C30H42O12/c1-14-24(38-16(3)32)11-22-26(40-18(5)34)10-21(13-31)23(37)12-25(39-17(4)33)15(2)28(41-19(6)35)29(42-20(7)36)27(14)30(22,8)9/h10,22-26,29,31,37H,11-13H2,1-9H3/b21-10+,28-15-/t22-,23+,24-,25-,26-,29+/m0/s1 > USDGRBIQBGVGOS-IHDQKDFMSA-N > C30H42O12 > 594.654 > 594.267626792 > 7 > 84 > 60.70316766269923 > 0 > 2 > 0 > 0 > (1R,2S,3E,5R,7S,8Z,10R,13S)-2,7,9,10-tetrakis(acetyloxy)-5-hydroxy-4-(hydroxymethyl)-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,8,11-trien-13-yl acetate > -0.19184609766666844 > 0 > 2 > 0 > 15.254719598257537 > 14.353953592484004 > -2.7659948879273424 > 171.95999999999998 > 148.78830000000002 > 11 > 0 > (1R,2S,3E,5R,7S,8Z,10R,13S)-2,7,9,10-tetrakis(acetyloxy)-5-hydroxy-4-(hydroxymethyl)-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,8,11-trien-13-yl acetate > 0 > NP0319194 > (1r,2s,3e,5r,7s,8z,10r,13s)-2,7,9,10-tetrakis(acetyloxy)-5-hydroxy-4-(hydroxymethyl)-8,12,15,15-tetramethylbicyclo[9.3.1]pentadeca-3,8,11-trien-13-yl acetate $$$$