Mrv1652309042214352D 35 38 0 0 1 0 999 V2000 2.4491 0.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7821 -0.2509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6066 -0.2773 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.8093 0.5570 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 4.2582 -0.7833 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9408 -0.3200 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5924 -0.8260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3323 -0.3782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3125 -1.6021 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.1949 -1.6623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4879 -1.5757 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.1676 -2.1691 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 -2.3517 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.7773 -3.3324 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1117 -4.2244 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9175 -4.6368 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3165 -4.7780 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5254 -2.8151 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.9148 -3.5424 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.4326 -2.8902 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4633 -4.1916 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4797 -4.2433 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7495 -5.2399 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6551 -4.2169 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2657 -3.4896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7008 -2.7887 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.8297 -3.0157 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0492 -2.2826 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 1.1122 -2.2533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2275 -2.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4448 -2.6015 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3792 -1.4541 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8195 -1.4902 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 1.2874 -0.8598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0994 -0.7142 0.0000 C 0 0 2 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 3 5 1 0 0 0 0 5 6 1 6 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 6 0 0 0 9 11 1 0 0 0 0 5 11 1 0 0 0 0 11 12 1 1 0 0 0 11 13 1 0 0 0 0 13 14 1 1 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 2 0 0 0 0 13 18 1 0 0 0 0 18 19 1 1 0 0 0 19 20 1 1 0 0 0 19 21 1 6 0 0 0 19 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 18 26 1 0 0 0 0 26 27 1 6 0 0 0 26 28 1 0 0 0 0 28 29 1 1 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 32 2 0 0 0 0 28 33 1 0 0 0 0 33 34 1 6 0 0 0 35 34 1 6 0 0 0 2 35 1 0 0 0 0 33 35 1 0 0 0 0 M END > NP0194838 > NP-MRD > C[C@H]1C(=O)O[C@H]2[C@@H](Cl)C(=C)[C@H]3O[C@H]3[C@H](OC(C)=O)[C@]3(C)C=CC(=O)[C@@](C)(O)[C@@H]3[C@H](OC(C)=O)[C@@]12O > InChI=1S/C24H29ClO10/c1-9-14(25)18-24(31,10(2)21(29)35-18)20(33-12(4)27)17-22(5,8-7-13(28)23(17,6)30)19(32-11(3)26)16-15(9)34-16/h7-8,10,14-20,30-31H,1H2,2-6H3/t10-,14-,15+,16+,17+,18-,19-,20-,22+,23+,24+/m0/s1 > ZMZWRXWIJZDCCP-UQRQEXTGSA-N > C24H29ClO10 > 512.94 > 512.1449248 > 7 > 64 > 48.19702636523911 > 1 > 2 > 0 > 0 > (1R,2R,3R,5R,7S,8R,11R,12S,13S,14S,15S)-2-(acetyloxy)-7-chloro-12,15-dihydroxy-1,11,15-trimethyl-6-methylidene-10,16-dioxo-4,9-dioxatetracyclo[12.4.0.0^{3,5}.0^{8,12}]octadec-17-en-13-yl acetate > 0.7489085633333323 > 0 > 4 > 0 > 13.041722627120198 > 12.262119929293156 > -3.704040437861374 > 148.96000000000004 > 118.3569 > 4 > 0 > (1R,2R,3R,5R,7S,8R,11R,12S,13S,14S,15S)-2-(acetyloxy)-7-chloro-12,15-dihydroxy-1,11,15-trimethyl-6-methylidene-10,16-dioxo-4,9-dioxatetracyclo[12.4.0.0^{3,5}.0^{8,12}]octadec-17-en-13-yl acetate > 0 > NP0194838 > (1r,2r,3r,5r,7s,8r,11r,12s,13s,14s,15s)-2-(acetyloxy)-7-chloro-12,15-dihydroxy-1,11,15-trimethyl-6-methylidene-10,16-dioxo-4,9-dioxatetracyclo[12.4.0.0³,⁵.0⁸,¹²]octadec-17-en-13-yl acetate $$$$