Mrv1652309062201072D 33 36 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 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 1 0 0 0 0 0 0 0 0 0 1.9953 1.1179 0.0000 O 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 2 0 0 0 0 3 5 1 0 0 0 0 5 6 1 1 0 0 0 7 6 1 1 0 0 0 2 7 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 1 0 0 0 9 11 1 0 0 0 0 11 5 1 1 0 0 0 11 12 1 0 0 0 0 12 13 1 1 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 6 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 2 0 0 0 0 15 20 1 0 0 0 0 20 21 1 6 0 0 0 20 22 1 1 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 2 0 0 0 0 20 27 1 0 0 0 0 12 27 1 0 0 0 0 27 28 1 1 0 0 0 28 29 2 0 0 0 0 12 30 1 0 0 0 0 30 31 1 0 0 0 0 31 32 1 0 0 0 0 5 32 1 0 0 0 0 32 33 2 0 0 0 0 M END > NP0221522 > NP-MRD > CC(=O)OC[C@]1(C)[C@H](CC[C@]2(COC(=O)[C@@]34C[C@@H](C[C@@H](O)[C@@H]23)C(=C)C4=O)[C@@H]1C=O)OC(C)=O > InChI=1S/C24H30O9/c1-12-15-7-16(28)19-23(11-32-21(30)24(19,8-15)20(12)29)6-5-18(33-14(3)27)22(4,17(23)9-25)10-31-13(2)26/h9,15-19,28H,1,5-8,10-11H2,2-4H3/t15-,16-,17-,18+,19+,22+,23+,24+/m1/s1 > BAQMGVVHZMKNPB-AULQEXAJSA-N > C24H30O9 > 462.495 > 462.188982546 > 6 > 63 > 46.4949632942901 > 1 > 1 > 0 > 1 > [(1R,1'S,2S,3R,4S,6'S,7'R,9'S)-4-(acetyloxy)-2-formyl-7'-hydroxy-3-methyl-10'-methylidene-2',11'-dioxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0^{1,6}]dodecane]-3-yl]methyl acetate > 0.33892060233333354 > 1 > 4 > 0 > 14.984905943789837 > 14.07931411452677 > -2.863710559919724 > 133.27 > 112.14489999999996 > 6 > 1 > (1R,1'S,2S,3R,4S,6'S,7'R,9'S)-4-(acetyloxy)-2-formyl-7'-hydroxy-3-methyl-10'-methylidene-2',11'-dioxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0^{1,6}]dodecane]-3-ylmethyl acetate > 0 > NP0221522 > (1r,1's,2s,3r,4s,6's,7'r,9's)-4-(acetyloxy)-2-formyl-7'-hydroxy-3-methyl-10'-methylidene-2',11'-dioxo-3'-oxaspiro[cyclohexane-1,5'-tricyclo[7.2.1.0¹,⁶]dodecan]-3-ylmethyl acetate $$$$