Mrv1652309022223102D 35 38 0 0 1 0 999 V2000 -1.5934 0.0346 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7732 -0.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3405 -0.8079 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6942 -1.5532 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5166 -1.6195 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8703 -2.3648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9852 -0.9405 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5433 -0.6618 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.2321 -0.0191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1943 0.5868 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5250 1.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2946 0.6824 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2988 -0.1972 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.0329 -0.6099 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0256 0.2151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7364 0.6339 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4545 0.2277 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1653 0.6465 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8834 0.2403 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5942 0.6591 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8907 -0.5847 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4618 -0.5973 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2729 -0.4469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7508 -1.3700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2261 -2.0067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5151 -2.7794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3288 -2.9155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9904 -3.4160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7510 -1.0161 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.7582 -1.8411 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0474 -2.2598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0565 -1.4412 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3537 -1.8845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6211 -1.5020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0639 -1.9617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 3 8 1 0 0 0 0 8 9 1 1 0 0 0 10 9 1 1 0 0 0 2 10 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 13 12 1 1 0 0 0 8 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 1 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 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 17 22 1 0 0 0 0 22 23 1 6 0 0 0 22 24 1 1 0 0 0 24 25 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 28 2 0 0 0 0 22 29 1 0 0 0 0 14 29 1 0 0 0 0 29 30 1 1 0 0 0 30 31 2 0 0 0 0 14 32 1 0 0 0 0 32 33 1 0 0 0 0 33 34 1 0 0 0 0 8 34 1 0 0 0 0 34 35 2 0 0 0 0 M END > NP0162710 > NP-MRD > CC(=O)OC[C@]1(C)[C@H](CC[C@]2(COC(=O)[C@@]34C[C@@H](CC[C@@H]23)C(=C)C4OC(C)=O)[C@@H]1C=O)OC(C)=O > InChI=1S/C26H34O9/c1-14-18-6-7-19-25(13-33-23(31)26(19,10-18)22(14)35-17(4)30)9-8-21(34-16(3)29)24(5,20(25)11-27)12-32-15(2)28/h11,18-22H,1,6-10,12-13H2,2-5H3/t18-,19+,20-,21+,22?,24+,25-,26+/m1/s1 > MSMFJFBUEIHNHZ-KBMFATIWSA-N > C26H34O9 > 490.549 > 490.220282675 > 5 > 69 > 50.44043702888863 > 1 > 0 > 0 > 0 > [(1R,1'S,2S,3R,4S,6'S,9'R)-4,11'-bis(acetyloxy)-2-formyl-3-methyl-10'-methylidene-2'-oxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0^{1,6}]dodecane]-3-yl]methyl acetate > 1.48 > 1.1692562000000013 > -4.32 > 1 > 4 > 0 > 14.573334322260912 > -6.340692021643581 > 122.27000000000001 > 120.32039999999996 > 8 > 1 > 2.35e-02 g/l > (1R,1'S,2S,3R,4S,6'S,9'R)-4,11'-bis(acetyloxy)-2-formyl-3-methyl-10'-methylidene-2'-oxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0^{1,6}]dodecane]-3-ylmethyl acetate > 0 > NP0162710 > (1r,1's,2s,3r,4s,6's,9'r)-4,11'-bis(acetyloxy)-2-formyl-3-methyl-10'-methylidene-2'-oxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0¹,⁶]dodecan]-3-ylmethyl acetate $$$$