Mrv1652309122217532D 46 52 0 0 1 0 999 V2000 4.1720 2.8087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4998 2.0516 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8277 1.2945 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2569 2.3794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9193 1.8877 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.8247 1.0681 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4871 0.5764 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3925 -0.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0549 -0.7349 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2442 0.9042 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.9067 0.4125 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3389 1.7238 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.0959 2.0516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6764 2.2155 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7710 3.0351 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7428 1.7238 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.0803 2.2155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3232 1.8877 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6608 2.3794 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2286 1.0681 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9817 1.8553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8911 0.5764 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.7964 -0.2431 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0393 -0.5710 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3769 -0.0792 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2823 -0.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6198 -0.4071 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.5252 -1.2266 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1326 -1.7849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7894 -2.5351 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0302 -2.4405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1935 -1.6318 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0426 0.0847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0520 0.9042 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6104 1.3960 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8091 1.2321 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.5662 1.5599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4715 0.7403 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.6481 0.9042 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4052 1.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0676 0.7403 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9730 -0.0792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6354 -0.5710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2159 -0.4071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5535 0.0847 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.1337 -0.6255 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 2 3 1 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 1 0 0 0 8 9 1 0 0 0 0 7 10 1 0 0 0 0 10 11 1 6 0 0 0 10 12 1 0 0 0 0 12 13 1 1 0 0 0 12 14 1 0 0 0 0 5 14 1 0 0 0 0 14 15 1 6 0 0 0 16 2 1 1 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 1 0 0 0 20 22 1 0 0 0 0 22 23 1 1 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 25 26 1 6 0 0 0 25 27 1 0 0 0 0 27 28 1 6 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 28 32 2 0 0 0 0 27 33 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 6 0 0 0 38 37 1 6 0 0 0 36 38 1 0 0 0 0 25 38 1 0 0 0 0 20 38 1 0 0 0 0 22 39 1 0 0 0 0 16 39 1 0 0 0 0 39 40 1 1 0 0 0 40 41 1 0 0 0 0 41 42 1 0 0 0 0 42 43 2 0 0 0 0 42 44 1 0 0 0 0 44 45 1 0 0 0 0 39 45 1 0 0 0 0 45 46 1 6 0 0 0 M END > NP0330485 > NP-MRD > CC(C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H]1CC(=O)[C@]2(C)[C@H](CC[C@@]3(C)[C@@H](OC(=O)[C@@H]4O[C@]234)C2=COC=C2)[C@]11COC(=O)C[C@@H]1O > InChI=1S/C32H42O14/c1-28(2,46-27-23(39)22(38)21(37)15(11-33)43-27)17-9-18(34)30(4)16(31(17)13-42-20(36)10-19(31)35)5-7-29(3)24(14-6-8-41-12-14)44-26(40)25-32(29,30)45-25/h6,8,12,15-17,19,21-25,27,33,35,37-39H,5,7,9-11,13H2,1-4H3/t15-,16+,17+,19+,21-,22+,23-,24+,25+,27+,29+,30+,31-,32+/m1/s1 > XXFBIXAPEIVYDP-VHWUBIICSA-N > C32H42O14 > 650.674 > 650.257456032 > 11 > 88 > 64.1244557806656 > 0 > 5 > 0 > 0 > (1'S,2'R,3R,4S,5'R,7'R,10'S,11'R,14'R)-11'-(furan-3-yl)-4-hydroxy-2',10'-dimethyl-5'-(2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-12',15'-dioxaspiro[oxane-3,6'-tetracyclo[8.5.0.0^{1,14}.0^{2,7}]pentadecane]-3',6,13'-trione > -0.4753480770000023 > 0 > 7 > 0 > 13.17260646126331 > 12.206946413631359 > -2.8728200697690816 > 214.95 > 150.64260000000002 > 5 > 0 > (1'S,2'R,3R,4S,5'R,7'R,10'S,11'R,14'R)-11'-(furan-3-yl)-4-hydroxy-2',10'-dimethyl-5'-(2-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-12',15'-dioxaspiro[oxane-3,6'-tetracyclo[8.5.0.0^{1,14}.0^{2,7}]pentadecane]-3',6,13'-trione > 0 > NP0330485 > (1's,2'r,3r,4s,5'r,7'r,10's,11's,14'r)-11'-(furan-3-yl)-4-hydroxy-2',10'-dimethyl-5'-(2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-12',15'-dioxaspiro[oxane-3,6'-tetracyclo[8.5.0.0¹,¹⁴.0²,⁷]pentadecane]-3',6,13'-trione $$$$