Mrv1652309072211552D 44 47 0 0 1 0 999 V2000 2.7071 4.1387 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4297 3.7405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1358 4.1671 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4461 2.9157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1686 2.5174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 1.6926 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.6766 2.3551 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3486 3.1122 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8402 3.7747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5123 4.5317 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6598 3.6802 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4962 2.2607 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8242 1.5037 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.3326 0.8411 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5130 0.9356 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.1256 0.2072 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9220 -0.0084 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0927 -0.6171 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7901 -1.0579 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5205 -0.6742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7571 -1.8822 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3146 0.0559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -0.7404 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6907 0.5956 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5110 -0.2096 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8965 0.3722 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4386 1.0585 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.6143 1.0915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9498 1.7061 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7264 2.5002 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9269 2.7039 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3509 2.1133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7036 3.4981 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7236 1.4200 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3887 1.9082 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.2374 2.7192 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4594 2.9937 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6370 2.9280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3081 3.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5301 4.0791 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7383 4.5086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1521 0.7467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4129 -0.0360 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9768 0.7240 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 6 5 1 1 0 0 0 6 7 1 0 0 0 0 7 8 1 6 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 2 0 0 0 0 7 12 1 0 0 0 0 13 12 1 6 0 0 0 14 13 1 0 0 0 0 15 14 1 1 0 0 0 6 15 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 1 0 0 0 16 18 1 6 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 21 2 0 0 0 0 16 22 1 0 0 0 0 22 23 2 0 0 0 0 24 22 1 0 0 0 0 24 25 1 6 0 0 0 24 26 1 0 0 0 0 27 26 1 0 0 0 0 27 28 1 6 0 0 0 29 27 1 0 0 0 0 29 30 1 6 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 31 33 2 0 0 0 0 34 29 1 6 0 0 0 34 24 1 0 0 0 0 35 34 1 0 0 0 0 6 35 1 0 0 0 0 35 36 1 1 0 0 0 36 37 1 0 0 0 0 37 38 2 0 0 0 0 37 39 1 0 0 0 0 39 40 1 0 0 0 0 39 41 1 0 0 0 0 14 42 1 6 0 0 0 13 42 1 0 0 0 0 42 43 1 0 0 0 0 42 44 1 0 0 0 0 M END > NP0247901 > NP-MRD > CC(C)C(=O)O[C@@H]1[C@H]2[C@@H](OC(C)=O)[C@@H](C)C[C@]2(O)C(=O)[C@@](C)(OC(C)=O)[C@@H]2[C@@H]3[C@H](C[C@@H](OC(C)=O)[C@@]12COC(C)=O)C3(C)C > InChI=1S/C32H46O12/c1-14(2)27(37)43-26-23-24(42-18(6)35)15(3)12-32(23,39)28(38)30(10,44-19(7)36)25-22-20(29(22,8)9)11-21(41-17(5)34)31(25,26)13-40-16(4)33/h14-15,20-26,39H,11-13H2,1-10H3/t15-,20-,21+,22-,23+,24-,25-,26+,30-,31+,32+/m0/s1 > ZMOIGFFTSFEHJH-PDJXXINVSA-N > C32H46O12 > 622.708 > 622.298926921 > 7 > 90 > 63.59662092775007 > 0 > 1 > 0 > 0 > (1R,2R,3R,4S,5S,7R,9S,10R,11S,13S,15R)-4,9,15-tris(acetyloxy)-1-[(acetyloxy)methyl]-7-hydroxy-5,9,12,12-tetramethyl-8-oxotetracyclo[8.5.0.0^{3,7}.0^{11,13}]pentadecan-2-yl 2-methylpropanoate > 2.097838553999998 > 1 > 4 > 0 > 12.584748326181181 > -3.855231082128353 > 168.79999999999998 > 150.51170000000005 > 12 > 0 > (1R,2R,3R,4S,5S,7R,9S,10R,11S,13S,15R)-4,9,15-tris(acetyloxy)-1-[(acetyloxy)methyl]-7-hydroxy-5,9,12,12-tetramethyl-8-oxotetracyclo[8.5.0.0^{3,7}.0^{11,13}]pentadecan-2-yl 2-methylpropanoate > 0 > NP0247901 > (1r,2r,3r,4s,5s,7r,9s,10r,11s,13s,15r)-4,9,15-tris(acetyloxy)-1-[(acetyloxy)methyl]-7-hydroxy-5,9,12,12-tetramethyl-8-oxotetracyclo[8.5.0.0³,⁷.0¹¹,¹³]pentadecan-2-yl 2-methylpropanoate $$$$