Mrv1652309012223002D 33 36 0 0 1 0 999 V2000 -1.6160 1.6082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0434 1.0142 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2716 0.2214 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2428 1.2130 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3298 0.6190 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0430 -0.1545 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.7784 -0.2318 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1222 -0.9817 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9436 -1.0590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6446 -1.6544 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4690 -0.8610 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2869 -0.9685 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8809 -0.3960 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.6309 -0.7398 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3036 -0.2622 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0536 -0.6059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2264 0.5592 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.8991 1.0368 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6490 0.6930 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7263 -0.1284 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3217 1.1706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0717 0.8268 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7444 1.3044 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1489 0.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4764 0.9030 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8037 0.4254 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7880 1.2503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4945 1.6762 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1133 0.8771 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2208 1.6951 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0084 -0.0725 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8217 0.0659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5350 -0.7076 0.0000 O 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 5 4 1 1 0 0 0 5 6 1 0 0 0 0 6 7 1 6 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 2 0 0 0 0 6 11 1 0 0 0 0 11 12 1 6 0 0 0 13 12 1 1 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 6 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 17 25 1 0 0 0 0 25 26 1 0 0 0 0 13 26 1 0 0 0 0 26 27 1 6 0 0 0 27 28 1 0 0 0 0 26 29 1 0 0 0 0 5 29 1 0 0 0 0 29 30 1 1 0 0 0 29 31 1 0 0 0 0 11 31 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 31 33 1 0 0 0 0 M END > NP0142464 > NP-MRD > CC(C)CC(=O)O[C@H]1C[C@@]2(CO)[C@H](O[C@@H]3[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@]2(C)C32CO2)C=C1C > InChI=1S/C24H34O9/c1-12(2)7-18(28)32-16-9-23(10-25)17(8-13(16)3)33-21-19(30-14(4)26)20(31-15(5)27)22(23,6)24(21)11-29-24/h8,12,16-17,19-21,25H,7,9-11H2,1-6H3/t16-,17+,19+,20+,21+,22+,23+,24?/m0/s1 > ZTSXGHQXQTWINZ-GOLADLMOSA-N > C24H34O9 > 466.527 > 466.220282675 > 6 > 67 > 48.68770671470959 > 1 > 1 > 0 > 1 > (1'S,2'R,4'S,7'R,9'R,10'R,11'S)-10',11'-bis(acetyloxy)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-4'-yl 3-methylbutanoate > 2.04 > 1.0194375570000007 > -3.15 > 1 > 4 > 0 > 14.988923630100924 > -2.803644804193854 > 120.89 > 113.5432 > 9 > 1 > 3.29e-01 g/l > (1'S,2'R,4'S,7'R,9'R,10'R,11'S)-10',11'-bis(acetyloxy)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0^{2,7}]dodecan]-5'-en-4'-yl 3-methylbutanoate > 0 > NP0142464 > (1's,2'r,4's,7'r,9'r,10'r,11's)-10',11'-bis(acetyloxy)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-en-4'-yl 3-methylbutanoate $$$$