Mrv1652309122217152D 51 53 0 0 1 0 999 V2000 4.1024 0.9059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3063 0.1065 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1312 0.0965 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3544 0.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1538 1.0946 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3769 1.8889 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8007 2.4792 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1763 2.0928 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8407 -0.3246 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2445 -1.0440 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0439 -0.8401 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2671 -0.0459 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6908 0.5445 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0665 0.1580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2896 0.9522 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0890 1.1561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6653 0.5658 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4421 -0.2285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6427 -0.4324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2345 -1.8690 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5073 -2.6476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0487 -1.7355 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5151 -2.2728 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0940 -2.9822 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2691 -2.9723 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.0459 -3.7665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5597 -2.5511 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9693 -3.1274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1558 -1.8317 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8509 -2.5983 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0345 -2.7175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7296 -3.4841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5231 -2.0701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3682 -2.0772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8913 -1.4039 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2850 -0.8445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2716 -1.9485 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4901 -1.6841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3284 -0.8751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1296 -2.2287 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3843 -0.7424 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.1389 0.0452 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 0.2265 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0886 1.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7746 -0.3799 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1658 -1.0068 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.5869 -0.2974 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.0106 0.2930 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2338 1.0872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6575 1.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0332 1.2911 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 6 0 0 0 4 5 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 3 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 1 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 14 19 1 0 0 0 0 10 20 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 25 26 1 1 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 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 29 34 1 0 0 0 0 34 35 1 0 0 0 0 35 36 1 6 0 0 0 35 37 1 1 0 0 0 37 38 1 0 0 0 0 38 39 1 0 0 0 0 38 40 2 0 0 0 0 35 41 1 0 0 0 0 41 42 1 6 0 0 0 42 43 1 0 0 0 0 43 44 1 0 0 0 0 43 45 2 0 0 0 0 46 41 1 6 0 0 0 29 46 1 0 0 0 0 46 47 1 0 0 0 0 2 47 1 0 0 0 0 47 48 1 1 0 0 0 48 49 1 0 0 0 0 49 50 1 0 0 0 0 49 51 2 0 0 0 0 M END > NP0330171 > NP-MRD > CC(C)CO[C@@H]1C[C@@H](OC(=O)C2=CC=CN=C2)C(C)(C)\C=C\[C@@H](C)C(=O)[C@]2(C[C@@](C)(OC(C)=O)[C@H](OC(C)=O)[C@@H]2[C@@H](OC(C)=O)C1=C)OC(C)=O > InChI=1S/C38H51NO12/c1-21(2)19-46-29-17-30(49-35(45)28-13-12-16-39-18-28)36(9,10)15-14-22(3)33(44)38(51-27(8)43)20-37(11,50-26(7)42)34(48-25(6)41)31(38)32(23(29)4)47-24(5)40/h12-16,18,21-22,29-32,34H,4,17,19-20H2,1-3,5-11H3/b15-14+/t22-,29-,30-,31+,32+,34-,37-,38-/m1/s1 > GEQXZNXXYBZFOZ-BGJWXCAQSA-N > C38H51NO12 > 713.821 > 713.341126086 > 8 > 102 > 74.26500499984934 > 0 > 0 > 0 > 0 > (2R,3R,3aS,4R,6R,8R,12R,13aR)-2,3,4,13a-tetrakis(acetyloxy)-2,9,9,12-tetramethyl-5-methylidene-6-(2-methylpropoxy)-13-oxo-1H,2H,3H,3aH,4H,5H,6H,7H,8H,9H,12H,13H,13aH-cyclopenta[12]annulen-8-yl pyridine-3-carboxylate > 4.061707603999999 > 1 > 3 > 0 > 14.966608249694115 > 3.2408070978657726 > 170.69000000000003 > 182.72860000000003 > 14 > 0 > (2R,3R,3aS,4R,6R,8R,12R,13aR)-2,3,4,13a-tetrakis(acetyloxy)-2,9,9,12-tetramethyl-5-methylidene-6-(2-methylpropoxy)-13-oxo-1H,3H,3aH,4H,6H,7H,8H,12H-cyclopenta[12]annulen-8-yl pyridine-3-carboxylate > 0 > NP0330171 > (2r,3r,3as,4r,6r,8r,12r,13ar)-2,3,4,13a-tetrakis(acetyloxy)-2,9,9,12-tetramethyl-5-methylidene-6-(2-methylpropoxy)-13-oxo-1h,3h,3ah,4h,6h,7h,8h,12h-cyclopenta[12]annulen-8-yl pyridine-3-carboxylate $$$$